N-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[4-(4-isobutylphenyl)-5-methyl-thiazol-2-yl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[[5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiazolyl]amino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[4-(4-isobutylphenyl)-5-methyl-thiazol-2-yl]thiocarbamoyl]thiophene-2-carboxamide Formula: C20H21N3OS3 MolecularWeight: 415.59524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=S)NC(=O)C2=CC=CS2)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CC1=C(N=C(S1)NC(=S)NC(=O)C2=CC=CS2)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C20H21N3OS3/c1-12(2)11-14-6-8-15(9-7-14)17-13(3)27-20(21-17)23-19(25)22-18(24)16-5-4-10-26-16/h4-10,12H,11H2,1-3H3,(H2,21,22,23,24,25)