2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-[(4-methoxyphenyl)methyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3-[(4-methoxyphenyl)methyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3-[(4-methoxyphenyl)methyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-3-[(4-methoxyphenyl)methyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-[(4-methoxyphenyl)methyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(2-keto-3,3-dimethyl-butyl)thio]-3-p-anisyl-thieno[3,2-d]pyrimidin-4-one Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=C(C(=O)N1CC3=CC=C(C=C3)OC)SC=C2

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=C(C(=O)N1CC3=CC=C(C=C3)OC)SC=C2

InChI

InChI=1S/C20H22N2O3S2/c1-20(2,3)16(23)12-27-19-21-15-9-10-26-17(15)18(24)22(19)11-13-5-7-14(25-4)8-6-13/h5-10H,11-12H2,1-4H3