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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(5,6-dimethyl-2-propan-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5,6-dimethyl-2-propan-2-yl-4-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(5,6-dimethyl-2-propan-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: 2-[(2-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)thio]-N-piperonyl-acetamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)C(C)C)SCC(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)C(C)C)SCC(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H23N3O3S2/c1-11(2)19-23-20(18-12(3)13(4)29-21(18)24-19)28-9-17(25)22-8-14-5-6-15-16(7-14)27-10-26-15/h5-7,11H,8-10H2,1-4H3,(H,22,25)