3-(4-butylphenyl)-5,6-dimethyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(4-butylphenyl)-5,6-dimethyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(4-butylphenyl)-5,6-dimethyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(4-butylphenyl)-5,6-dimethyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-(4-butylphenyl)-5,6-dimethyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-butylphenyl)-5,6-dimethyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C18H20N2OS2 MolecularWeight: 344.4942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC(=C3C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC(=C3C)C

InChI

InChI=1S/C18H20N2OS2/c1-4-5-6-13-7-9-14(10-8-13)20-17(21)15-11(2)12(3)23-16(15)19-18(20)22/h7-10H,4-6H2,1-3H3,(H,19,22)