N-[2-(3-carbamimidoylphenyl)-4-[5-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-quinoxalin-6-yl]benzamide

Systemtic Name: N-[2-(3-carbamimidoylphenyl)-4-[5-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-quinoxalin-6-yl]benzamide Openeye Name: N-[2-(3-carbamimidoylphenyl)-4-[5-(2,6-dimethyl-1-piperidyl)pentyl]-3-oxo-quinoxalin-6-yl]benzamide CAS Name: N-[2-(3-carbamimidoylphenyl)-4-[5-(2,6-dimethyl-1-piperidinyl)pentyl]-3-oxo-6-quinoxalinyl]benzamide IUPAC Name: N-[2-(3-carbamimidoylphenyl)-4-[5-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxoquinoxalin-6-yl]benzamide Traditional Name: N-[2-(3-amidinophenyl)-4-[5-(2,6-dimethylpiperidino)pentyl]-3-keto-quinoxalin-6-yl]benzamide Formula: C34H40N6O2 MolecularWeight: 564.7204

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCCCN2C3=C(C=CC(=C3)NC(=O)C4=CC=CC=C4)N=C(C2=O)C5=CC(=CC=C5)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1CCCCCN2C3=C(C=CC(=C3)NC(=O)C4=CC=CC=C4)N=C(C2=O)C5=CC(=CC=C5)C(=N)N)C

InChI

InChI=1S/C34H40N6O2/c1-23-11-9-12-24(2)39(23)19-7-4-8-20-40-30-22-28(37-33(41)25-13-5-3-6-14-25)17-18-29(30)38-31(34(40)42)26-15-10-16-27(21-26)32(35)36/h3,5-6,10,13-18,21-24H,4,7-9,11-12,19-20H2,1-2H3,(H3,35,36)(H,37,41)