2-(6-aminocarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-N-(4-methylphenyl)sulfonyl-ethanimidate

Systemtic Name: 2-(6-aminocarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-N-(4-methylphenyl)sulfonyl-ethanimidate Openeye Name: 2-(6-carbamoyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-N-(p-tolylsulfonyl)ethanimidate CAS Name: 2-(6-carbamoyl-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-N-(4-methylphenyl)sulfonylethanimidate IUPAC Name: 2-(6-carbamoyl-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-(4-methylphenyl)sulfonylethanimidate Traditional Name: 2-(6-carbamoyl-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl)-N-tosyl-acetimidate Formula: C17H15N4O5S2- MolecularWeight: 419.4548

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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)C(=O)N)C)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O5S2/c1-9-3-5-11(6-4-9)28(25,26)20-12(22)7-21-8-19-16-13(17(21)24)10(2)14(27-16)15(18)23/h3-6,8H,7H2,1-2H3,(H2,18,23)(H,20,22)/p-1