N-(4-fluorophenyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-fluorophenyl)-2-phenyl-acetamide CAS Name: N-(4-fluorophenyl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: N-(4-fluorophenyl)-2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(4-fluorophenyl)-2-phenyl-acetamide Formula: C23H18FN3O2S2 MolecularWeight: 451.536323

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F)SC=C2

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F)SC=C2

InChI

InChI=1S/C23H18FN3O2S2/c1-2-13-27-22(29)18-12-14-30-21(18)26-23(27)31-19(15-6-4-3-5-7-15)20(28)25-17-10-8-16(24)9-11-17/h2-12,14,19H,1,13H2,(H,25,28)