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

Systemtic Name: ethyl (E)-4-[(4-butan-2-yloxyphenyl)carbamothioylamino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-oxo-4-[(4-sec-butoxyphenyl)carbamothioylamino]but-2-enoate CAS Name: (E)-4-[[(4-butan-2-yloxyanilino)-sulfanylidenemethyl]amino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(4-butan-2-yloxyphenyl)carbamothioylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[(4-sec-butoxyphenyl)thiocarbamoylamino]but-2-enoic acid ethyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)NC(=S)NC(=O)C=CC(=O)OCC

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C17H22N2O4S/c1-4-12(3)23-14-8-6-13(7-9-14)18-17(24)19-15(20)10-11-16(21)22-5-2/h6-12H,4-5H2,1-3H3,(H2,18,19,20,24)/b11-10+