N-(3-chloranyl-2-methyl-phenyl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-propanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(3-chloro-2-methyl-phenyl)propanamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(3-chloro-2-methylphenyl)propanamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(3-chloro-2-methylphenyl)propanamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(3-chloro-2-methyl-phenyl)propionamide Formula: C22H21ClN2O3S2 MolecularWeight: 460.99674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(C)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21ClN2O3S2/c1-15-20(23)9-6-10-21(15)24-22(26)16(2)29-18-13-11-17(12-14-18)25-30(27,28)19-7-4-3-5-8-19/h3-14,16,25H,1-2H3,(H,24,26)