(2R)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-naphthalen-2-yl-N-pyridin-3-yl-propanamide

Systemtic Name: (2R)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-naphthalen-2-yl-N-pyridin-3-yl-propanamide Openeye Name: (2R)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-(2-naphthyl)-N-(3-pyridyl)propanamide CAS Name: (2R)-2-[[(cyclohexylamino)-cyclohexyliminomethyl]amino]-3-(2-naphthalenyl)-N-(3-pyridinyl)propanamide IUPAC Name: (2R)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-naphthalen-2-yl-N-pyridin-3-ylpropanamide Traditional Name: (2R)-2-[(N,N'-dicyclohexylamidino)amino]-3-(2-naphthyl)-N-(3-pyridyl)propionamide Formula: C31H39N5O MolecularWeight: 497.67426

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=NC2CCCCC2)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NC5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=NC2CCCCC2)N[C@H](CC3=CC4=CC=CC=C4C=C3)C(=O)NC5=CN=CC=C5

InChI

InChI=1S/C31H39N5O/c37-30(33-28-16-9-19-32-22-28)29(21-23-17-18-24-10-7-8-11-25(24)20-23)36-31(34-26-12-3-1-4-13-26)35-27-14-5-2-6-15-27/h7-11,16-20,22,26-27,29H,1-6,12-15,21H2,(H,33,37)(H2,34,35,36)/t29-/m1/s1