butyl 4-[(2-cyano-3-thiophen-2-yl-prop-2-enoyl)amino]benzoate

Systemtic Name: butyl 4-[(2-cyano-3-thiophen-2-yl-prop-2-enoyl)amino]benzoate Openeye Name: butyl 4-[[2-cyano-3-(2-thienyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[(2-cyano-1-oxo-3-thiophen-2-ylprop-2-enyl)amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2-cyano-3-thiophen-2-ylprop-2-enoyl)amino]benzoate Traditional Name: 4-[[2-cyano-3-(2-thienyl)acryloyl]amino]benzoic acid butyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=CS2)C#N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=CS2)C#N

InChI

InChI=1S/C19H18N2O3S/c1-2-3-10-24-19(23)14-6-8-16(9-7-14)21-18(22)15(13-20)12-17-5-4-11-25-17/h4-9,11-12H,2-3,10H2,1H3,(H,21,22)