4-[[(E)-2-cyano-3-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[(E)-2-cyano-3-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide Openeye Name: 4-[[(E)-2-cyano-3-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide CAS Name: 4-[[(E)-2-cyano-3-[1-(4-ethoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-1-oxoprop-2-enyl]amino]-N-cyclopropylbenzamide IUPAC Name: 4-[[(E)-2-cyano-3-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enoyl]amino]-N-cyclopropylbenzamide Traditional Name: 4-[[(E)-2-cyano-3-(2,5-dimethyl-1-p-phenetyl-pyrrol-3-yl)acryloyl]amino]-N-cyclopropyl-benzamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)NC4CC4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)C(=O)NC4CC4)C

InChI

InChI=1S/C28H28N4O3/c1-4-35-26-13-11-25(12-14-26)32-18(2)15-21(19(32)3)16-22(17-29)28(34)31-23-7-5-20(6-8-23)27(33)30-24-9-10-24/h5-8,11-16,24H,4,9-10H2,1-3H3,(H,30,33)(H,31,34)/b22-16+