2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide Formula: C17H16N6O3S MolecularWeight: 384.41234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C17H16N6O3S/c1-9-19-11-5-4-10(6-12(11)27-9)20-13(24)7-23-8-18-15-14(23)16(25)22(3)17(26)21(15)2/h4-6,8H,7H2,1-3H3,(H,20,24)