N-[4-methyl-3-[[4-(pyridin-3-ylmethylsulfanyl)phenyl]sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-methyl-3-[[4-(pyridin-3-ylmethylsulfanyl)phenyl]sulfamoyl]phenyl]ethanamide Openeye Name: N-[4-methyl-3-[[4-(3-pyridylmethylsulfanyl)phenyl]sulfamoyl]phenyl]acetamide CAS Name: N-[4-methyl-3-[[4-(3-pyridinylmethylthio)phenyl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[4-methyl-3-[[4-(pyridin-3-ylmethylsulfanyl)phenyl]sulfamoyl]phenyl]acetamide Traditional Name: N-[4-methyl-3-[[4-(3-pyridylmethylthio)phenyl]sulfamoyl]phenyl]acetamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C)S(=O)(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C21H21N3O3S2/c1-15-5-6-19(23-16(2)25)12-21(15)29(26,27)24-18-7-9-20(10-8-18)28-14-17-4-3-11-22-13-17/h3-13,24H,14H2,1-2H3,(H,23,25)