5-(3,4-dimethylphenyl)-6-methyl-3-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethylphenyl)-6-methyl-3-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-5-(3,4-dimethylphenyl)-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethylphenyl)-6-methyl-3-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-benzyl-5-(3,4-dimethylphenyl)-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-5-(3,4-dimethylphenyl)-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2OS2 MolecularWeight: 392.537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC3=C2C(=O)N(C(=S)N3)CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC3=C2C(=O)N(C(=S)N3)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C22H20N2OS2/c1-13-9-10-17(11-14(13)2)18-15(3)27-20-19(18)21(25)24(22(26)23-20)12-16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H,23,26)