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

Systemtic Name: 4-[[(E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide Openeye Name: 4-[[(E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoyl]amino]-N-cyclopropyl-benzamide CAS Name: 4-[[(E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-1-oxoprop-2-enyl]amino]-N-cyclopropylbenzamide IUPAC Name: 4-[[(E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enoyl]amino]-N-cyclopropylbenzamide Traditional Name: 4-[[(E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]acryloyl]amino]-N-cyclopropyl-benzamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)NC4CC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)C(=O)NC4CC4

InChI

InChI=1S/C27H26N4O3/c1-17-14-20(18(2)31(17)24-10-12-25(34-3)13-11-24)15-21(16-28)27(33)30-22-6-4-19(5-7-22)26(32)29-23-8-9-23/h4-7,10-15,23H,8-9H2,1-3H3,(H,29,32)(H,30,33)/b21-15+