methyl 2-[2-[1-(4-methylphenyl)sulfonylpyrrol-2-yl]-4-oxidanylidene-1,3-thiazinan-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[1-(4-methylphenyl)sulfonylpyrrol-2-yl]-4-oxidanylidene-1,3-thiazinan-3-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[1-(p-tolylsulfonyl)pyrrol-2-yl]-1,3-thiazinan-3-yl]acetate CAS Name: 2-[2-[1-(4-methylphenyl)sulfonyl-2-pyrrolyl]-4-oxo-1,3-thiazinan-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[1-(4-methylphenyl)sulfonylpyrrol-2-yl]-4-oxo-1,3-thiazinan-3-yl]acetate Traditional Name: 2-[4-keto-2-(1-tosylpyrrol-2-yl)-1,3-thiazinan-3-yl]acetic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2C3N(C(=O)CCS3)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2C3N(C(=O)CCS3)CC(=O)OC

InChI

InChI=1S/C18H20N2O5S2/c1-13-5-7-14(8-6-13)27(23,24)20-10-3-4-15(20)18-19(12-17(22)25-2)16(21)9-11-26-18/h3-8,10,18H,9,11-12H2,1-2H3