N-cyclohexyl-2-[4-oxidanylidene-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[4-oxidanylidene-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-cyclohexyl-acetamide CAS Name: N-cyclohexyl-2-[[4-oxo-3-(phenylmethyl)-2-thieno[3,2-d]pyrimidinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-cyclohexylacetamide Traditional Name: 2-[(3-benzyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]-N-cyclohexyl-acetamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC=C3

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC=C3

InChI

InChI=1S/C21H23N3O2S2/c25-18(22-16-9-5-2-6-10-16)14-28-21-23-17-11-12-27-19(17)20(26)24(21)13-15-7-3-1-4-8-15/h1,3-4,7-8,11-12,16H,2,5-6,9-10,13-14H2,(H,22,25)