4,5-dimethyl-2-[(4-methylphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[(4-methylphenyl)carbonylcarbamothioylamino]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-2-[(4-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide CAS Name: 4,5-dimethyl-2-[[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-2-[(4-methylbenzoyl)carbamothioylamino]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-2-(p-toluoylthiocarbamoylamino)thiophene-3-carboxamide Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N

InChI

InChI=1S/C16H17N3O2S2/c1-8-4-6-11(7-5-8)14(21)18-16(22)19-15-12(13(17)20)9(2)10(3)23-15/h4-7H,1-3H3,(H2,17,20)(H2,18,19,21,22)