N-(2,1,3-benzothiadiazol-4-yl)-2-(1-cyclopentyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(1-cyclopentyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(1-cyclopentyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[(1-cyclopentyl-6-hydroxy-4-oxo-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(1-cyclopentyl-6-hydroxy-4-oxopyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(1-cyclopentyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]-N-piazthiol-4-yl-acetamide Formula: C17H17N5O3S2 MolecularWeight: 403.47858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NC3=CC=CC4=NSN=C43)O

Isomeric SMILES

C1CCC(C1)N2C(=CC(=O)N=C2SCC(=O)NC3=CC=CC4=NSN=C43)O

InChI

InChI=1S/C17H17N5O3S2/c23-13-8-15(25)22(10-4-1-2-5-10)17(19-13)26-9-14(24)18-11-6-3-7-12-16(11)21-27-20-12/h3,6-8,10,25H,1-2,4-5,9H2,(H,18,24)