2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C13H15N7O3S2 MolecularWeight: 381.4333

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C13H15N7O3S2/c1-4-24-12-17-16-11(25-12)15-7(21)5-20-6-14-9-8(20)10(22)19(3)13(23)18(9)2/h6H,4-5H2,1-3H3,(H,15,16,21)