2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(5-sulfamoylthiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(5-sulfamoylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(5-sulfamoyl-2-thienyl)methyl]acetamide CAS Name: 2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(5-sulfamoyl-2-thiophenyl)methyl]acetamide IUPAC Name: 2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(5-sulfamoyl-2-thienyl)methyl]acetamide Formula: C16H17N5O3S3 MolecularWeight: 423.53288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)NCC3=CC=C(S3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)NCC3=CC=C(S3)S(=O)(=O)N

InChI

InChI=1S/C16H17N5O3S3/c1-10-3-2-4-11(7-10)15-19-20-16(25)21(15)9-13(22)18-8-12-5-6-14(26-12)27(17,23)24/h2-7H,8-9H2,1H3,(H,18,22)(H,20,25)(H2,17,23,24)