4-[(2-methylphenyl)methylsulfanyl]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[(2-methylphenyl)methylsulfanyl]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-3-nitro-4-(o-tolylmethylsulfanyl)benzenesulfonamide CAS Name: 4-[(2-methylphenyl)methylthio]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[(2-methylphenyl)methylsulfanyl]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-4-[(2-methylbenzyl)thio]-3-nitro-benzenesulfonamide Formula: C17H20N2O4S2 MolecularWeight: 380.4817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C=C(C=C2)S(=O)(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C=C(C=C2)S(=O)(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O4S2/c1-12(2)18-25(22,23)15-8-9-17(16(10-15)19(20)21)24-11-14-7-5-4-6-13(14)3/h4-10,12,18H,11H2,1-3H3