S-ethyl 1-(4-methylphenyl)sulfonyl-3-[(4-nitrophenyl)sulfonylmethyl]-3,6-dihydro-2H-pyridine-4-carbothioate

Systemtic Name: S-ethyl 1-(4-methylphenyl)sulfonyl-3-[(4-nitrophenyl)sulfonylmethyl]-3,6-dihydro-2H-pyridine-4-carbothioate Openeye Name: S-ethyl 3-[(4-nitrophenyl)sulfonylmethyl]-1-(p-tolylsulfonyl)-3,6-dihydro-2H-pyridine-4-carbothioate CAS Name: 1-(4-methylphenyl)sulfonyl-3-[(4-nitrophenyl)sulfonylmethyl]-3,6-dihydro-2H-pyridine-4-carbothioic acid S-ethyl ester IUPAC Name: S-ethyl 1-(4-methylphenyl)sulfonyl-3-[(4-nitrophenyl)sulfonylmethyl]-3,6-dihydro-2H-pyridine-4-carbothioate Traditional Name: 3-(nosylmethyl)-1-tosyl-3,6-dihydro-2H-pyridine-4-carbothioic acid S-ethyl ester Formula: C22H24N2O7S3 MolecularWeight: 524.63016

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C1=CCN(CC1CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCSC(=O)C1=CCN(CC1CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N2O7S3/c1-3-32-22(25)21-12-13-23(34(30,31)20-8-4-16(2)5-9-20)14-17(21)15-33(28,29)19-10-6-18(7-11-19)24(26)27/h4-12,17H,3,13-15H2,1-2H3