N-(5-azanylpentyl)-2-methyl-4-[6-(1-pyridin-3-ylbutylamino)pyrazin-2-yl]benzamide

Systemtic Name: N-(5-azanylpentyl)-2-methyl-4-[6-(1-pyridin-3-ylbutylamino)pyrazin-2-yl]benzamide Openeye Name: N-(5-aminopentyl)-2-methyl-4-[6-[1-(3-pyridyl)butylamino]pyrazin-2-yl]benzamide CAS Name: N-(5-aminopentyl)-2-methyl-4-[6-[1-(3-pyridinyl)butylamino]-2-pyrazinyl]benzamide IUPAC Name: N-(5-aminopentyl)-2-methyl-4-[6-(1-pyridin-3-ylbutylamino)pyrazin-2-yl]benzamide Traditional Name: N-(5-aminopentyl)-2-methyl-4-[6-[1-(3-pyridyl)butylamino]pyrazin-2-yl]benzamide Formula: C26H34N6O MolecularWeight: 446.58776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CN=CC=C1)NC2=NC(=CN=C2)C3=CC(=C(C=C3)C(=O)NCCCCCN)C

Isomeric SMILES

CCCC(C1=CN=CC=C1)NC2=NC(=CN=C2)C3=CC(=C(C=C3)C(=O)NCCCCCN)C

InChI

InChI=1S/C26H34N6O/c1-3-8-23(21-9-7-13-28-16-21)31-25-18-29-17-24(32-25)20-10-11-22(19(2)15-20)26(33)30-14-6-4-5-12-27/h7,9-11,13,15-18,23H,3-6,8,12,14,27H2,1-2H3,(H,30,33)(H,31,32)