1-[2-butyl-7-methyl-3-(phenylmethyl)imidazo[4,5-b]pyridin-6-yl]-3-ethyl-urea

Systemtic Name: 1-[2-butyl-7-methyl-3-(phenylmethyl)imidazo[4,5-b]pyridin-6-yl]-3-ethyl-urea Openeye Name: 1-(3-benzyl-2-butyl-7-methyl-imidazo[4,5-b]pyridin-6-yl)-3-ethyl-urea CAS Name: 1-[2-butyl-7-methyl-3-(phenylmethyl)-6-imidazo[4,5-b]pyridinyl]-3-ethylurea IUPAC Name: 1-(3-benzyl-2-butyl-7-methylimidazo[4,5-b]pyridin-6-yl)-3-ethylurea Traditional Name: 1-(3-benzyl-2-butyl-7-methyl-imidazo[4,5-b]pyridin-6-yl)-3-ethyl-urea Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=CN=C2N1CC3=CC=CC=C3)NC(=O)NCC)C

Isomeric SMILES

CCCCC1=NC2=C(C(=CN=C2N1CC3=CC=CC=C3)NC(=O)NCC)C

InChI

InChI=1S/C21H27N5O/c1-4-6-12-18-25-19-15(3)17(24-21(27)22-5-2)13-23-20(19)26(18)14-16-10-8-7-9-11-16/h7-11,13H,4-6,12,14H2,1-3H3,(H2,22,24,27)