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

Systemtic Name: 5-(4-tert-butylphenyl)-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-tert-butylphenyl)-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-tert-butylphenyl)-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-tert-butylphenyl)-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-tert-butylphenyl)-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)NC(=S)NC2=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C2=C(S1)NC(=S)NC2=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C17H18N2OS2/c1-9-12(10-5-7-11(8-6-10)17(2,3)4)13-14(20)18-16(21)19-15(13)22-9/h5-8H,1-4H3,(H2,18,19,20,21)