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

Systemtic Name: 3-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-N-cyclopropyl-benzamide Openeye Name: 3-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoyl]amino]-N-cyclopropyl-benzamide CAS Name: 3-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-1-oxoprop-2-enyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[[(E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enoyl]amino]-N-cyclopropylbenzamide Traditional Name: 3-[[(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acryloyl]amino]-N-cyclopropyl-benzamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C

InChI

InChI=1S/C23H26N4O2/c1-4-10-27-15(2)11-18(16(27)3)12-19(14-24)23(29)26-21-7-5-6-17(13-21)22(28)25-20-8-9-20/h5-7,11-13,20H,4,8-10H2,1-3H3,(H,25,28)(H,26,29)/b19-12+