N-[3-(3-carbamimidoylphenyl)-5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-2-oxidanylidene-1H-quinolin-7-yl]ethanamide

Systemtic Name: N-[3-(3-carbamimidoylphenyl)-5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-2-oxidanylidene-1H-quinolin-7-yl]ethanamide Openeye Name: N-[3-(3-carbamimidoylphenyl)-5-[1-(2,6-dimethyl-1-piperidyl)pentyl]-2-oxo-1H-quinolin-7-yl]acetamide CAS Name: N-[3-(3-carbamimidoylphenyl)-5-[1-(2,6-dimethyl-1-piperidinyl)pentyl]-2-oxo-1H-quinolin-7-yl]acetamide IUPAC Name: N-[3-(3-carbamimidoylphenyl)-5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-2-oxo-1H-quinolin-7-yl]acetamide Traditional Name: N-[3-(3-amidinophenyl)-5-[1-(2,6-dimethylpiperidino)pentyl]-2-keto-1H-quinolin-7-yl]acetamide Formula: C30H39N5O2 MolecularWeight: 501.66296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=CC2=C1C=C(C(=O)N2)C3=CC(=CC=C3)C(=N)N)NC(=O)C)N4C(CCCC4C)C

Isomeric SMILES

CCCCC(C1=CC(=CC2=C1C=C(C(=O)N2)C3=CC(=CC=C3)C(=N)N)NC(=O)C)N4C(CCCC4C)C

InChI

InChI=1S/C30H39N5O2/c1-5-6-13-28(35-18(2)9-7-10-19(35)3)26-15-23(33-20(4)36)16-27-25(26)17-24(30(37)34-27)21-11-8-12-22(14-21)29(31)32/h8,11-12,14-19,28H,5-7,9-10,13H2,1-4H3,(H3,31,32)(H,33,36)(H,34,37)