5-[(Z)-C-methyl-N-[(phenylmethyl)carbamothioylamino]carbonimidoyl]thiophene-2-carboxylate

Systemtic Name: 5-[(Z)-C-methyl-N-[(phenylmethyl)carbamothioylamino]carbonimidoyl]thiophene-2-carboxylate Openeye Name: 5-[(Z)-N-(benzylcarbamothioylamino)-C-methyl-carbonimidoyl]thiophene-2-carboxylate CAS Name: 5-[(1Z)-1-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]ethyl]-2-thiophenecarboxylate IUPAC Name: 5-[(Z)-N-(benzylcarbamothioylamino)-C-methylcarbonimidoyl]thiophene-2-carboxylate Traditional Name: 5-[(Z)-N-(benzylthiocarbamoylamino)-C-methyl-carbonimidoyl]-2-thenoate Formula: C15H14N3O2S2- MolecularWeight: 332.42056

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1=CC=CC=C1)C2=CC=C(S2)C(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=S)NCC1=CC=CC=C1)/C2=CC=C(S2)C(=O)[O-]

InChI

InChI=1S/C15H15N3O2S2/c1-10(12-7-8-13(22-12)14(19)20)17-18-15(21)16-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,19,20)(H2,16,18,21)/p-1/b17-10-