2-chloranyl-5-[(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)sulfamoyl]-N-(4-methylphenyl)-4-sulfanyl-benzamide

Systemtic Name: 2-chloranyl-5-[(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)sulfamoyl]-N-(4-methylphenyl)-4-sulfanyl-benzamide Openeye Name: 2-chloro-5-[(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)sulfamoyl]-N-(p-tolyl)-4-sulfanyl-benzamide CAS Name: 2-chloro-4-mercapto-5-[(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)sulfamoyl]-N-(4-methylphenyl)benzamide IUPAC Name: 2-chloro-5-[(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)sulfamoyl]-N-(4-methylphenyl)-4-sulfanylbenzamide Traditional Name: 2-chloro-4-mercapto-5-[(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)sulfamoyl]-N-(p-tolyl)benzamide Formula: C18H20ClN5O3S2 MolecularWeight: 453.9661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)S)S(=O)(=O)NC3=NCCN(N3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)S)S(=O)(=O)NC3=NCCN(N3)C

InChI

InChI=1S/C18H20ClN5O3S2/c1-11-3-5-12(6-4-11)21-17(25)13-9-16(15(28)10-14(13)19)29(26,27)23-18-20-7-8-24(2)22-18/h3-6,9-10,28H,7-8H2,1-2H3,(H,21,25)(H2,20,22,23)