(3S)-N-ethyl-1-[2-[(4-methylpiperidin-4-yl)carbonylamino]-3-naphthalen-2-yl-propanoyl]-3-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-ethyl-1-[2-[(4-methylpiperidin-4-yl)carbonylamino]-3-naphthalen-2-yl-propanoyl]-3-(phenylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-(2-naphthyl)propanoyl]piperidine-3-carboxamide CAS Name: (3S)-N-ethyl-1-[2-[[(4-methyl-4-piperidinyl)-oxomethyl]amino]-3-(2-naphthalenyl)-1-oxopropyl]-3-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide Traditional Name: (3S)-3-benzyl-N-ethyl-1-[2-[(4-methylisonipecotoyl)amino]-3-(2-naphthyl)propanoyl]nipecotamide Formula: C35H44N4O3 MolecularWeight: 568.74886

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1(CCCN(C1)C(=O)C(CC2=CC3=CC=CC=C3C=C2)NC(=O)C4(CCNCC4)C)CC5=CC=CC=C5

Isomeric SMILES

CCNC(=O)[C@@]1(CCCN(C1)C(=O)C(CC2=CC3=CC=CC=C3C=C2)NC(=O)C4(CCNCC4)C)CC5=CC=CC=C5

InChI

InChI=1S/C35H44N4O3/c1-3-37-33(42)35(24-26-10-5-4-6-11-26)16-9-21-39(25-35)31(40)30(38-32(41)34(2)17-19-36-20-18-34)23-27-14-15-28-12-7-8-13-29(28)22-27/h4-8,10-15,22,30,36H,3,9,16-21,23-25H2,1-2H3,(H,37,42)(H,38,41)/t30?,35-/m0/s1