3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(1-pyridin-2-ylethyl)propanamide

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(1-pyridin-2-ylethyl)propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-[1-(2-pyridyl)ethyl]propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[1-(2-pyridinyl)ethyl]propanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(1-pyridin-2-ylethyl)propanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-[1-(2-pyridyl)ethyl]propionamide Formula: C17H20N6O3 MolecularWeight: 356.3791

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)NC(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C1=CC=CC=N1)NC(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H20N6O3/c1-11(12-6-4-5-8-18-12)20-13(24)7-9-23-10-19-15-14(23)16(25)22(3)17(26)21(15)2/h4-6,8,10-11H,7,9H2,1-3H3,(H,20,24)