2-(3-cyclopentyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: 2-(3-cyclopentyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-cyclopentyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-acetamide CAS Name: 2-[(3-cyclopentyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: 2-(3-cyclopentyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-2-phenyl-acetamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C3=CC=CC=C3)C(=O)N)C4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C3=CC=CC=C3)C(=O)N)C4CCCC4)C

InChI

InChI=1S/C21H23N3O2S2/c1-12-13(2)27-19-16(12)20(26)24(15-10-6-7-11-15)21(23-19)28-17(18(22)25)14-8-4-3-5-9-14/h3-5,8-9,15,17H,6-7,10-11H2,1-2H3,(H2,22,25)