ethyl (E)-4-[(4-acetamidophenyl)carbamothioylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-[(4-acetamidophenyl)carbamothioylamino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[(4-acetamidophenyl)carbamothioylamino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[(4-acetamidoanilino)-sulfanylidenemethyl]amino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(4-acetamidophenyl)carbamothioylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-[(4-acetamidophenyl)thiocarbamoylamino]-4-keto-but-2-enoic acid ethyl ester Formula: C15H17N3O4S MolecularWeight: 335.37818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O4S/c1-3-22-14(21)9-8-13(20)18-15(23)17-12-6-4-11(5-7-12)16-10(2)19/h4-9H,3H2,1-2H3,(H,16,19)(H2,17,18,20,23)/b9-8+