N-(5-chloranyl-2-methoxy-phenyl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-(1,3-dimethyl-2,6-dioxo-7-purinyl)propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)propionamide Formula: C17H18ClN5O4 MolecularWeight: 391.80892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)N2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)N2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H18ClN5O4/c1-9(15(24)20-11-7-10(18)5-6-12(11)27-4)23-8-19-14-13(23)16(25)22(3)17(26)21(14)2/h5-9H,1-4H3,(H,20,24)