N-[2-[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoyl]-2-phenyl-ethanamide Openeye Name: N-[2-[3-allyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]-2-phenyl-acetamide CAS Name: N-[2-[[5-(4-methylphenyl)-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl]thio]-1-oxoethyl]-2-phenylacetamide IUPAC Name: N-[2-[5-(4-methylphenyl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]-2-phenylacetamide Traditional Name: N-[2-[[3-allyl-4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetyl]-2-phenyl-acetamide Formula: C26H23N3O3S2 MolecularWeight: 489.60912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC(=O)CC4=CC=CC=C4)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC(=O)CC4=CC=CC=C4)CC=C

InChI

InChI=1S/C26H23N3O3S2/c1-3-13-29-25(32)23-20(19-11-9-17(2)10-12-19)15-33-24(23)28-26(29)34-16-22(31)27-21(30)14-18-7-5-4-6-8-18/h3-12,15H,1,13-14,16H2,2H3,(H,27,30,31)