2-(2-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-(4-methylphenyl)sulfonyl-ethanimidate

Systemtic Name: 2-(2-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-(4-methylphenyl)sulfonyl-ethanimidate Openeye Name: 2-(2-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-(p-tolylsulfonyl)ethanimidate CAS Name: 2-(2-methyl-4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)-N-(4-methylphenyl)sulfonylethanimidate IUPAC Name: 2-(2-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)-N-(4-methylphenyl)sulfonylethanimidate Traditional Name: 2-(4-keto-2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-tosyl-acetimidate Formula: C22H18N3O4S2- MolecularWeight: 452.52602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(CN2C(=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(CN2C(=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)C)[O-]

InChI

InChI=1S/C22H19N3O4S2/c1-14-8-10-17(11-9-14)31(28,29)24-20(26)13-25-15(2)23-21-18(22(25)27)12-19(30-21)16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,24,26)/p-1