N-[ethanoyl-[(E)-(phenylmethylidene)amino]carbamothioyl]ethanamide

Systemtic Name: N-[ethanoyl-[(E)-(phenylmethylidene)amino]carbamothioyl]ethanamide Openeye Name: N-[acetyl-[(E)-benzylideneamino]carbamothioyl]acetamide CAS Name: N-[[acetyl-[(E)-(phenylmethylene)amino]amino]-sulfanylidenemethyl]acetamide IUPAC Name: N-[acetyl-[(E)-benzylideneamino]carbamothioyl]acetamide Traditional Name: N-[acetyl-[(E)-benzalamino]thiocarbamoyl]acetamide Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)NC(=S)N(C(=O)C)/N=C/C1=CC=CC=C1

InChI

InChI=1S/C12H13N3O2S/c1-9(16)14-12(18)15(10(2)17)13-8-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,14,16,18)/b13-8+