2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C18H18N6O4S MolecularWeight: 414.43832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N=C(S2)NC(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N=C(S2)NC(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C18H18N6O4S/c1-9-5-6-10(28-4)12-14(9)29-17(21-12)20-11(25)7-24-8-19-15-13(24)16(26)23(3)18(27)22(15)2/h5-6,8H,7H2,1-4H3,(H,20,21,25)