N-[2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-(dimethylsulfamoyl)benzamide

Systemtic Name: N-[2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-4-(dimethylsulfamoyl)benzamide Openeye Name: N-[2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4-(dimethylsulfamoyl)benzamide CAS Name: N-[2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-4-(dimethylsulfamoyl)benzamide IUPAC Name: N-[2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-(dimethylsulfamoyl)benzamide Traditional Name: N-[2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]-4-(dimethylsulfamoyl)benzamide Formula: C20H21N5O4S3 MolecularWeight: 491.60684

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C3CC3)C4=CC=CS4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C3CC3)C4=CC=CS4

InChI

InChI=1S/C20H21N5O4S3/c1-24(2)32(28,29)15-9-5-13(6-10-15)19(27)21-17(26)12-31-20-23-22-18(16-4-3-11-30-16)25(20)14-7-8-14/h3-6,9-11,14H,7-8,12H2,1-2H3,(H,21,26,27)