N-(2-methyl-5-nitro-phenyl)-2-[4-[(4-methylphenyl)sulfonylamino]phenyl]sulfanyl-propanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[4-[(4-methylphenyl)sulfonylamino]phenyl]sulfanyl-propanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-[4-(p-tolylsulfonylamino)phenyl]sulfanyl-propanamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-[[4-[(4-methylphenyl)sulfonylamino]phenyl]thio]propanamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-[4-[(4-methylphenyl)sulfonylamino]phenyl]sulfanylpropanamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-2-[[4-(tosylamino)phenyl]thio]propionamide Formula: C23H23N3O5S2 MolecularWeight: 485.57582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H23N3O5S2/c1-15-4-12-21(13-5-15)33(30,31)25-18-7-10-20(11-8-18)32-17(3)23(27)24-22-14-19(26(28)29)9-6-16(22)2/h4-14,17,25H,1-3H3,(H,24,27)