2-chloranyl-N-[3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propyl]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)propyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[3-(1,3-dimethyl-2,6-dioxo-7-purinyl)propyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[3-(1,3-dimethyl-2,6-dioxopurin-7-yl)propyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[3-(2,6-diketo-1,3-dimethyl-purin-7-yl)propyl]nicotinamide Formula: C16H17ClN6O3 MolecularWeight: 376.79758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCNC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCNC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C16H17ClN6O3/c1-21-13-11(15(25)22(2)16(21)26)23(9-20-13)8-4-7-19-14(24)10-5-3-6-18-12(10)17/h3,5-6,9H,4,7-8H2,1-2H3,(H,19,24)