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

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

CCC1=C(C2=C(S1)NC(=S)NC2=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=C(C2=C(S1)NC(=S)NC2=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C18H20N2OS2/c1-5-12-13(10-6-8-11(9-7-10)18(2,3)4)14-15(21)19-17(22)20-16(14)23-12/h6-9H,5H2,1-4H3,(H2,19,20,21,22)