3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-N-[2-(1-methylpyrrol-2-yl)ethyl]propanamide

Systemtic Name: 3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-N-[2-(1-methylpyrrol-2-yl)ethyl]propanamide Openeye Name: 3-(2-amino-6-oxo-3H-purin-9-yl)-N-[2-(1-methylpyrrol-2-yl)ethyl]propanamide CAS Name: 3-(2-amino-6-oxo-3H-purin-9-yl)-N-[2-(1-methyl-2-pyrrolyl)ethyl]propanamide IUPAC Name: 3-(2-amino-6-oxo-3H-purin-9-yl)-N-[2-(1-methylpyrrol-2-yl)ethyl]propanamide Traditional Name: 3-(2-amino-6-keto-3H-purin-9-yl)-N-[2-(1-methylpyrrol-2-yl)ethyl]propionamide Formula: C15H19N7O2 MolecularWeight: 329.35706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CCNC(=O)CCN2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CN1C=CC=C1CCNC(=O)CCN2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C15H19N7O2/c1-21-7-2-3-10(21)4-6-17-11(23)5-8-22-9-18-12-13(22)19-15(16)20-14(12)24/h2-3,7,9H,4-6,8H2,1H3,(H,17,23)(H3,16,19,20,24)