N-(4-cyanophenyl)-3-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-cyanophenyl)-3-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-cyanophenyl)-3-(3-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-(4-cyanophenyl)-3-[(3-methyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(4-cyanophenyl)-3-(3-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(4-cyanophenyl)-3-[(4-keto-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionamide Formula: C23H18N4O2S2 MolecularWeight: 446.54462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCCC(=O)NC3=CC=C(C=C3)C#N)SC=C2C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCCC(=O)NC3=CC=C(C=C3)C#N)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C23H18N4O2S2/c1-27-22(29)20-18(16-5-3-2-4-6-16)14-31-21(20)26-23(27)30-12-11-19(28)25-17-9-7-15(13-24)8-10-17/h2-10,14H,11-12H2,1H3,(H,25,28)