2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-5-(3,4-dimethylphenyl)-3-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-5-(3,4-dimethylphenyl)-3-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-5-(3,4-dimethylphenyl)-3-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-5-(3,4-dimethylphenyl)-3-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-5-(3,4-dimethylphenyl)-3-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(3,4-dimethylphenyl)-2-[(2-keto-3,3-dimethyl-butyl)thio]-3-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H24N2O2S2 MolecularWeight: 400.55746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)C(C)(C)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)C(C)(C)C)C)C

InChI

InChI=1S/C21H24N2O2S2/c1-12-7-8-14(9-13(12)2)15-10-26-18-17(15)19(25)23(6)20(22-18)27-11-16(24)21(3,4)5/h7-10H,11H2,1-6H3