N-[[4-[(3-methylphenyl)carbonylamino]phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-[(3-methylphenyl)carbonylamino]phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[4-[(3-methylbenzoyl)amino]phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[4-[[(3-methylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-[(3-methylbenzoyl)amino]phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[4-(m-toluoylamino)phenyl]thiocarbamoyl]thiophene-2-carboxamide Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H17N3O2S2/c1-13-4-2-5-14(12-13)18(24)21-15-7-9-16(10-8-15)22-20(26)23-19(25)17-6-3-11-27-17/h2-12H,1H3,(H,21,24)(H2,22,23,25,26)