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

Systemtic Name: N-(2-cyanoethyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3)SC=C2

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3)SC=C2

InChI

InChI=1S/C20H18N4O2S2/c1-2-11-24-19(26)16-9-13-27-18(16)22-20(24)28-14-17(25)23(12-6-10-21)15-7-4-3-5-8-15/h2-5,7-9,13H,1,6,11-12,14H2