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

Systemtic Name: 2-chloranyl-N-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl]pyridine-3-carboxamide CAS Name: 2-chloro-N-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)ethyl]nicotinamide Formula: C15H15ClN6O3 MolecularWeight: 362.771

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClN6O3/c1-20-12-10(14(24)21(2)15(20)25)22(8-19-12)7-6-18-13(23)9-4-3-5-17-11(9)16/h3-5,8H,6-7H2,1-2H3,(H,18,23)