3-cyano-N-[(2R)-4-phenylbutan-2-yl]-1-(4-propan-2-ylphenyl)pyrrole-2-carboxamide

Systemtic Name: 3-cyano-N-[(2R)-4-phenylbutan-2-yl]-1-(4-propan-2-ylphenyl)pyrrole-2-carboxamide Openeye Name: 3-cyano-1-(4-isopropylphenyl)-N-[(1R)-1-methyl-3-phenyl-propyl]pyrrole-2-carboxamide CAS Name: 3-cyano-N-[(2R)-4-phenylbutan-2-yl]-1-(4-propan-2-ylphenyl)-2-pyrrolecarboxamide IUPAC Name: 3-cyano-N-[(2R)-4-phenylbutan-2-yl]-1-(4-propan-2-ylphenyl)pyrrole-2-carboxamide Traditional Name: 3-cyano-N-[(1R)-1-methyl-3-phenyl-propyl]-1-p-cumenyl-pyrrole-2-carboxamide Formula: C25H27N3O MolecularWeight: 385.50138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=CC(=C2C(=O)NC(C)CCC3=CC=CC=C3)C#N

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)C2=C(C=CN2C3=CC=C(C=C3)C(C)C)C#N

InChI

InChI=1S/C25H27N3O/c1-18(2)21-11-13-23(14-12-21)28-16-15-22(17-26)24(28)25(29)27-19(3)9-10-20-7-5-4-6-8-20/h4-8,11-16,18-19H,9-10H2,1-3H3,(H,27,29)/t19-/m1/s1