4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(4-phenylthiazol-2-yl)butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(4-phenyl-2-thiazolyl)butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(4-phenylthiazol-2-yl)butyramide Formula: C20H20N6O3S MolecularWeight: 424.4762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H20N6O3S/c1-24-17-16(18(28)25(2)20(24)29)26(12-21-17)10-6-9-15(27)23-19-22-14(11-30-19)13-7-4-3-5-8-13/h3-5,7-8,11-12H,6,9-10H2,1-2H3,(H,22,23,27)