2-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-[(4-methoxyphenyl)-prop-2-enyl-sulfamoyl]benzamide

Systemtic Name: 2-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-[(4-methoxyphenyl)-prop-2-enyl-sulfamoyl]benzamide Openeye Name: 5-[allyl-(4-methoxyphenyl)sulfamoyl]-2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-[(4-methoxyphenyl)-prop-2-enylsulfamoyl]benzamide IUPAC Name: 2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-[(4-methoxyphenyl)-prop-2-enylsulfamoyl]benzamide Traditional Name: 5-[allyl-(4-methoxyphenyl)sulfamoyl]-2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H21ClN4O4S3 MolecularWeight: 525.06384

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(CC=C)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(CC=C)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C21H21ClN4O4S3/c1-4-12-26(14-6-8-15(30-3)9-7-14)33(28,29)16-10-11-18(22)17(13-16)19(27)23-20-24-25-21(32-20)31-5-2/h4,6-11,13H,1,5,12H2,2-3H3,(H,23,24,27)