ethyl (E)-4-[(3,4-dimethylphenyl)carbamothioylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-[(3,4-dimethylphenyl)carbamothioylamino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[(3,4-dimethylphenyl)carbamothioylamino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[(3,4-dimethylanilino)-sulfanylidenemethyl]amino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(3,4-dimethylphenyl)carbamothioylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-[(3,4-dimethylphenyl)thiocarbamoylamino]-4-keto-but-2-enoic acid ethyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O3S/c1-4-20-14(19)8-7-13(18)17-15(21)16-12-6-5-10(2)11(3)9-12/h5-9H,4H2,1-3H3,(H2,16,17,18,21)/b8-7+