4-[6-[(3-ethyl-4-methyl-phenyl)methylamino]-4-oxidanylidene-5H-imidazo[4,5-c]pyridin-3-yl]butyl ethanoate

Systemtic Name: 4-[6-[(3-ethyl-4-methyl-phenyl)methylamino]-4-oxidanylidene-5H-imidazo[4,5-c]pyridin-3-yl]butyl ethanoate Openeye Name: 4-[6-[(3-ethyl-4-methyl-phenyl)methylamino]-4-oxo-5H-imidazo[4,5-c]pyridin-3-yl]butyl acetate CAS Name: acetic acid 4-[6-[(3-ethyl-4-methylphenyl)methylamino]-4-oxo-5H-imidazo[4,5-c]pyridin-3-yl]butyl ester IUPAC Name: 4-[6-[(3-ethyl-4-methylphenyl)methylamino]-4-oxo-5H-imidazo[4,5-c]pyridin-3-yl]butyl acetate Traditional Name: acetic acid 4-[6-[(3-ethyl-4-methyl-benzyl)amino]-4-keto-5H-imidazo[4,5-c]pyridin-3-yl]butyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O3/c1-4-18-11-17(8-7-15(18)2)13-23-20-12-19-21(22(28)25-20)26(14-24-19)9-5-6-10-29-16(3)27/h7-8,11-12,14H,4-6,9-10,13H2,1-3H3,(H2,23,25,28)