2-[(4-cyanophenyl)carbamoyl-cyclohexyl-amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]ethanamide

Systemtic Name: 2-[(4-cyanophenyl)carbamoyl-cyclohexyl-amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: 2-[(4-cyanophenyl)carbamoyl-cyclohexyl-amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]-cyclohexylamino]-N-cyclopropyl-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: 2-[(4-cyanophenyl)carbamoyl-cyclohexylamino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[(4-cyanophenyl)carbamoyl-cyclohexyl-amino]-N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(C2CC2)C(=O)CN(C3CCCCC3)C(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

CN1C=CC=C1CN(C2CC2)C(=O)CN(C3CCCCC3)C(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H31N5O2/c1-28-15-5-8-23(28)17-29(22-13-14-22)24(31)18-30(21-6-3-2-4-7-21)25(32)27-20-11-9-19(16-26)10-12-20/h5,8-12,15,21-22H,2-4,6-7,13-14,17-18H2,1H3,(H,27,32)