2-[7-ethyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[7-ethyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(7-ethyl-1,3-dimethyl-2,6-dioxo-purin-8-yl)sulfanyl-N-[4-(2-thienyl)thiazol-2-yl]acetamide CAS Name: 2-[(7-ethyl-1,3-dimethyl-2,6-dioxo-8-purinyl)thio]-N-(4-thiophen-2-yl-2-thiazolyl)acetamide IUPAC Name: 2-(7-ethyl-1,3-dimethyl-2,6-dioxopurin-8-yl)sulfanyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[(7-ethyl-2,6-diketo-1,3-dimethyl-purin-8-yl)thio]-N-[4-(2-thienyl)thiazol-2-yl]acetamide Formula: C18H18N6O3S3 MolecularWeight: 462.56892

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1SCC(=O)NC3=NC(=CS3)C4=CC=CS4)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(N=C1SCC(=O)NC3=NC(=CS3)C4=CC=CS4)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C18H18N6O3S3/c1-4-24-13-14(22(2)18(27)23(3)15(13)26)21-17(24)30-9-12(25)20-16-19-10(8-29-16)11-6-5-7-28-11/h5-8H,4,9H2,1-3H3,(H,19,20,25)