6-[(3-ethyl-4-methyl-phenyl)methylamino]-3-(5-oxidanylpentyl)-5H-imidazo[4,5-c]pyridin-4-one

Systemtic Name: 6-[(3-ethyl-4-methyl-phenyl)methylamino]-3-(5-oxidanylpentyl)-5H-imidazo[4,5-c]pyridin-4-one Openeye Name: 6-[(3-ethyl-4-methyl-phenyl)methylamino]-3-(5-hydroxypentyl)-5H-imidazo[4,5-c]pyridin-4-one CAS Name: 6-[(3-ethyl-4-methylphenyl)methylamino]-3-(5-hydroxypentyl)-5H-imidazo[4,5-c]pyridin-4-one IUPAC Name: 6-[(3-ethyl-4-methylphenyl)methylamino]-3-(5-hydroxypentyl)-5H-imidazo[4,5-c]pyridin-4-one Traditional Name: 6-[(3-ethyl-4-methyl-benzyl)amino]-3-(5-hydroxypentyl)-5H-imidazo[4,5-c]pyridin-4-one Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)CNC2=CC3=C(C(=O)N2)N(C=N3)CCCCCO)C

Isomeric SMILES

CCC1=C(C=CC(=C1)CNC2=CC3=C(C(=O)N2)N(C=N3)CCCCCO)C

InChI

InChI=1S/C21H28N4O2/c1-3-17-11-16(8-7-15(17)2)13-22-19-12-18-20(21(27)24-19)25(14-23-18)9-5-4-6-10-26/h7-8,11-12,14,26H,3-6,9-10,13H2,1-2H3,(H2,22,24,27)