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

Systemtic Name: (2R)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-naphthalen-2-yl-N-quinolin-3-yl-propanamide Openeye Name: (2R)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-(2-naphthyl)-N-(3-quinolyl)propanamide CAS Name: (2R)-2-[[(cyclohexylamino)-cyclohexyliminomethyl]amino]-3-(2-naphthalenyl)-N-(3-quinolinyl)propanamide IUPAC Name: (2R)-2-[(N,N'-dicyclohexylcarbamimidoyl)amino]-3-naphthalen-2-yl-N-quinolin-3-ylpropanamide Traditional Name: (2R)-2-[(N,N'-dicyclohexylamidino)amino]-3-(2-naphthyl)-N-(3-quinolyl)propionamide Formula: C35H41N5O MolecularWeight: 547.73294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=NC2CCCCC2)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC6=CC=CC=C6N=C5

Isomeric SMILES

C1CCC(CC1)NC(=NC2CCCCC2)N[C@H](CC3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC6=CC=CC=C6N=C5

InChI

InChI=1S/C35H41N5O/c41-34(37-31-23-28-13-9-10-18-32(28)36-24-31)33(22-25-19-20-26-11-7-8-12-27(26)21-25)40-35(38-29-14-3-1-4-15-29)39-30-16-5-2-6-17-30/h7-13,18-21,23-24,29-30,33H,1-6,14-17,22H2,(H,37,41)(H2,38,39,40)/t33-/m1/s1