N-(1,3-benzodioxol-5-yl)-2-(2-cyclohexyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(2-cyclohexyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(2-cyclohexyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(2-cyclohexyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(2-cyclohexyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(2-cyclohexyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)thio]acetamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)C3CCCCC3)SCC(=O)NC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)C3CCCCC3)SCC(=O)NC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C23H25N3O3S2/c1-13-14(2)31-23-20(13)22(25-21(26-23)15-6-4-3-5-7-15)30-11-19(27)24-16-8-9-17-18(10-16)29-12-28-17/h8-10,15H,3-7,11-12H2,1-2H3,(H,24,27)