2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-sulfamoyl-phenyl)ethanamide

Systemtic Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-sulfamoyl-phenyl)ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-sulfamoyl-phenyl)acetamide CAS Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-(4-methyl-3-sulfamoylphenyl)acetamide IUPAC Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-sulfamoylphenyl)acetamide Traditional Name: 2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-(4-methyl-3-sulfamoyl-phenyl)acetamide Formula: C19H21N5O3S3 MolecularWeight: 463.59674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C3CC3)CC4=CC=CS4)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C3CC3)CC4=CC=CS4)S(=O)(=O)N

InChI

InChI=1S/C19H21N5O3S3/c1-12-4-5-13(9-16(12)30(20,26)27)21-18(25)11-29-19-23-22-17(24(19)14-6-7-14)10-15-3-2-8-28-15/h2-5,8-9,14H,6-7,10-11H2,1H3,(H,21,25)(H2,20,26,27)