N-[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-(phenylmethyl)pentanamide

Systemtic Name: N-[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-(phenylmethyl)pentanamide Openeye Name: N-benzyl-N-[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]pentanamide CAS Name: N-[1-[3-(4-carbamimidoylphenyl)-1-oxopropyl]-3,4-dihydro-2H-quinolin-6-yl]-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-N-[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]pentanamide Traditional Name: N-[1-[3-(4-amidinophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]-N-benzyl-valeramide Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=CC=C1)C2=CC3=C(C=C2)N(CCC3)C(=O)CCC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CCCCC(=O)N(CC1=CC=CC=C1)C2=CC3=C(C=C2)N(CCC3)C(=O)CCC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C31H36N4O2/c1-2-3-11-29(36)35(22-24-8-5-4-6-9-24)27-17-18-28-26(21-27)10-7-20-34(28)30(37)19-14-23-12-15-25(16-13-23)31(32)33/h4-6,8-9,12-13,15-18,21H,2-3,7,10-11,14,19-20,22H2,1H3,(H3,32,33)