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

Systemtic Name: ethyl (E)-4-oxidanylidene-4-[(4-propoxyphenyl)carbamothioylamino]but-2-enoate Openeye Name: ethyl (E)-4-oxo-4-[(4-propoxyphenyl)carbamothioylamino]but-2-enoate CAS Name: (E)-4-oxo-4-[[(4-propoxyanilino)-sulfanylidenemethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-oxo-4-[(4-propoxyphenyl)carbamothioylamino]but-2-enoate Traditional Name: (E)-4-keto-4-[(4-propoxyphenyl)thiocarbamoylamino]but-2-enoic acid ethyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC(=S)NC(=O)C=CC(=O)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C16H20N2O4S/c1-3-11-22-13-7-5-12(6-8-13)17-16(23)18-14(19)9-10-15(20)21-4-2/h5-10H,3-4,11H2,1-2H3,(H2,17,18,19,23)/b10-9+