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1-[2-methyl-5-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]carbamoylamino]phenyl]-3-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]urea

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1-[2-methyl-5-[[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]carbamoylamino]phenyl]-3-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]urea
SpectraBase Compound ID 8RBWvkcXCMt
InChI InChI=1S/C27H24N8O2S2/c1-15-4-9-18(10-5-15)22-32-34-26(38-22)30-24(36)28-20-13-8-17(3)21(14-20)29-25(37)31-27-35-33-23(39-27)19-11-6-16(2)7-12-19/h4-14H,1-3H3,(H2,28,30,34,36)(H2,29,31,35,37)
InChIKey BSLLREDLQGSTJF-UHFFFAOYSA-N
Mol Weight 556.66 g/mol
Molecular Formula C27H24N8O2S2
Exact Mass 556.146364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33gOy1dPe8d
Name 1,1'-(4-METHYL-1,3-PHENYLENE)BIS{3-[5-(p-TOLYL)-1,3,4-THIADIAZOL-2-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H24N8O2S2
InChI InChI=1S/C27H24N8O2S2/c1-15-4-9-18(10-5-15)22-32-34-26(38-22)30-24(36)28-20-13-8-17(3)21(14-20)29-25(37)31-27-35-33-23(39-27)19-11-6-16(2)7-12-19/h4-14H,1-3H3,(H2,28,30,34,36)(H2,29,31,35,37)
InChIKey BSLLREDLQGSTJF-UHFFFAOYSA-N
Molecular Weight 556.1460
SMILES N(C(Nc1cc(NC(Nc2sc(-c3ccc(C)cc3)nn2)=O)ccc1C)=O)c1sc(-c2ccc(C)cc2)nn1
SPLASH splash10-0007-9500000000-f05bf345057f5ddb13c5
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany