ethyl (E)-4-oxidanylidene-4-(phenylcarbamothioylamino)but-2-enoate

Systemtic Name: ethyl (E)-4-oxidanylidene-4-(phenylcarbamothioylamino)but-2-enoate Openeye Name: ethyl (E)-4-oxo-4-(phenylcarbamothioylamino)but-2-enoate CAS Name: (E)-4-[[anilino(sulfanylidene)methyl]amino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-oxo-4-(phenylcarbamothioylamino)but-2-enoate Traditional Name: (E)-4-keto-4-(phenylthiocarbamoylamino)but-2-enoic acid ethyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)NC(=S)NC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C=C/C(=O)NC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C13H14N2O3S/c1-2-18-12(17)9-8-11(16)15-13(19)14-10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H2,14,15,16,19)/b9-8+