2,4-dimethyl-N-[(3R)-3-[4-[(4-methylpyridin-3-yl)methyl-phenyl-amino]piperidin-1-yl]butyl]-6-pyrrolidin-1-ylcarbonyl-pyridine-3-carboxamide

Systemtic Name: 2,4-dimethyl-N-[(3R)-3-[4-[(4-methylpyridin-3-yl)methyl-phenyl-amino]piperidin-1-yl]butyl]-6-pyrrolidin-1-ylcarbonyl-pyridine-3-carboxamide Openeye Name: 2,4-dimethyl-N-[(3R)-3-[4-[N-[(4-methyl-3-pyridyl)methyl]anilino]-1-piperidyl]butyl]-6-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide CAS Name: 2,4-dimethyl-N-[(3R)-3-[4-[N-[(4-methyl-3-pyridinyl)methyl]anilino]-1-piperidinyl]butyl]-6-[oxo(1-pyrrolidinyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2,4-dimethyl-N-[(3R)-3-[4-[N-[(4-methylpyridin-3-yl)methyl]anilino]piperidin-1-yl]butyl]-6-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide Traditional Name: 2,4-dimethyl-N-[(3R)-3-[4-[N-[(4-methyl-3-pyridyl)methyl]anilino]piperidino]butyl]-6-(pyrrolidine-1-carbonyl)nicotinamide Formula: C35H46N6O2 MolecularWeight: 582.77874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NC=C1)CN(C2CCN(CC2)C(C)CCNC(=O)C3=C(N=C(C=C3C)C(=O)N4CCCC4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=NC=C1)CN(C2CCN(CC2)[C@H](C)CCNC(=O)C3=C(N=C(C=C3C)C(=O)N4CCCC4)C)C5=CC=CC=C5

InChI

InChI=1S/C35H46N6O2/c1-25-12-16-36-23-29(25)24-41(30-10-6-5-7-11-30)31-14-20-39(21-15-31)27(3)13-17-37-34(42)33-26(2)22-32(38-28(33)4)35(43)40-18-8-9-19-40/h5-7,10-12,16,22-23,27,31H,8-9,13-15,17-21,24H2,1-4H3,(H,37,42)/t27-/m1/s1