tert-butyl N-[1-[4-(1-methyl-5-naphthalen-2-yl-6-oxidanylidene-4-pyridin-4-yl-pyridin-2-yl)piperidin-1-yl]-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-(1-methyl-5-naphthalen-2-yl-6-oxidanylidene-4-pyridin-4-yl-pyridin-2-yl)piperidin-1-yl]-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-[4-[1-methyl-5-(2-naphthyl)-6-oxo-4-(4-pyridyl)-2-pyridyl]-1-piperidyl]ethyl]carbamate CAS Name: N-[1-[4-[1-methyl-5-(2-naphthalenyl)-6-oxo-4-pyridin-4-yl-2-pyridinyl]-1-piperidinyl]-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-(1-methyl-5-naphthalen-2-yl-6-oxo-4-pyridin-4-ylpyridin-2-yl)piperidin-1-yl]-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[4-[6-keto-1-methyl-5-(2-naphthyl)-4-(4-pyridyl)-2-pyridyl]piperidino]ethyl]carbamic acid tert-butyl ester Formula: C40H44N4O3 MolecularWeight: 628.80236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CN2CCC(CC2)C3=CC(=C(C(=O)N3C)C4=CC5=CC=CC=C5C=C4)C6=CC=NC=C6

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CN2CCC(CC2)C3=CC(=C(C(=O)N3C)C4=CC5=CC=CC=C5C=C4)C6=CC=NC=C6

InChI

InChI=1S/C40H44N4O3/c1-40(2,3)47-39(46)42-34(24-28-10-6-5-7-11-28)27-44-22-18-31(19-23-44)36-26-35(30-16-20-41-21-17-30)37(38(45)43(36)4)33-15-14-29-12-8-9-13-32(29)25-33/h5-17,20-21,25-26,31,34H,18-19,22-24,27H2,1-4H3,(H,42,46)