2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[8-bromanyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-(4-phenylthiazol-2-yl)acetamide CAS Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxo-9-purinyl)-N-(4-phenyl-2-thiazolyl)acetamide IUPAC Name: 2-(8-bromo-1,3-dimethyl-2,6-dioxopurin-9-yl)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-(8-bromo-2,6-diketo-1,3-dimethyl-purin-9-yl)-N-(4-phenylthiazol-2-yl)acetamide Formula: C18H15BrN6O3S MolecularWeight: 475.3191

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)NC3=NC(=CS3)C4=CC=CC=C4)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC(=O)NC3=NC(=CS3)C4=CC=CC=C4)Br

InChI

InChI=1S/C18H15BrN6O3S/c1-23-14-13(15(27)24(2)18(23)28)22-16(19)25(14)8-12(26)21-17-20-11(9-29-17)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,20,21,26)