4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)butanamide Openeye Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)butanamide CAS Name: N-(5-acetyl-4-methyl-2-thiazolyl)-4-(1,3-dimethyl-2,6-dioxo-7-purinyl)butanamide IUPAC Name: N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butanamide Traditional Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-4-(2,6-diketo-1,3-dimethyl-purin-7-yl)butyramide Formula: C17H20N6O4S MolecularWeight: 404.4435

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCCN2C=NC3=C2C(=O)N(C(=O)N3C)C)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCCN2C=NC3=C2C(=O)N(C(=O)N3C)C)C(=O)C

InChI

InChI=1S/C17H20N6O4S/c1-9-13(10(2)24)28-16(19-9)20-11(25)6-5-7-23-8-18-14-12(23)15(26)22(4)17(27)21(14)3/h8H,5-7H2,1-4H3,(H,19,20,25)