4-chloranyl-3-(diethylsulfamoyl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-chloranyl-3-(diethylsulfamoyl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-chloro-3-(diethylsulfamoyl)benzamide CAS Name: 4-chloro-3-(diethylsulfamoyl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-chloro-3-(diethylsulfamoyl)benzamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-chloro-3-(diethylsulfamoyl)benzamide Formula: C20H21ClN4O3S3 MolecularWeight: 497.05374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H21ClN4O3S3/c1-3-25(4-2)31(27,28)17-12-15(10-11-16(17)21)18(26)22-19-23-24-20(30-19)29-13-14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3,(H,22,23,26)