(E)-2-cyano-3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(o-tolylmethyl)indol-3-yl]-N-(3-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[1-[(2-methylphenyl)methyl]-3-indolyl]-N-(3-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-[(2-methylphenyl)methyl]indol-3-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(2-methylbenzyl)indol-3-yl]-N-(3-pyridylmethyl)acrylamide Formula: C26H22N4O MolecularWeight: 406.47908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)/C=C(\C#N)/C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C26H22N4O/c1-19-7-2-3-9-21(19)17-30-18-23(24-10-4-5-11-25(24)30)13-22(14-27)26(31)29-16-20-8-6-12-28-15-20/h2-13,15,18H,16-17H2,1H3,(H,29,31)/b22-13+