propan-2-yl 2-[[(E)-2-cyano-3-[4-(4-methylphenyl)carbonyloxyphenyl]prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[[(E)-2-cyano-3-[4-(4-methylphenyl)carbonyloxyphenyl]prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: isopropyl 2-[[(E)-2-cyano-3-[4-(4-methylbenzoyl)oxyphenyl]prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[4-[(4-methylphenyl)-oxomethoxy]phenyl]-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[(E)-2-cyano-3-[4-(4-methylbenzoyl)oxyphenyl]prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(4-p-toluoyloxyphenyl)acryloyl]amino]thiophene-3-carboxylic acid isopropyl ester Formula: C26H22N2O5S MolecularWeight: 474.52828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=C(C=CS3)C(=O)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C(\C#N)/C(=O)NC3=C(C=CS3)C(=O)OC(C)C

InChI

InChI=1S/C26H22N2O5S/c1-16(2)32-26(31)22-12-13-34-24(22)28-23(29)20(15-27)14-18-6-10-21(11-7-18)33-25(30)19-8-4-17(3)5-9-19/h4-14,16H,1-3H3,(H,28,29)/b20-14+