5-bromanyl-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiophene-2-sulfonamide Openeye Name: 5-bromo-N-[1-(p-tolylmethyl)-1,2,4-triazol-3-yl]thiophene-2-sulfonamide CAS Name: 5-bromo-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiophene-2-sulfonamide Traditional Name: 5-bromo-N-[1-(4-methylbenzyl)-1,2,4-triazol-3-yl]thiophene-2-sulfonamide Formula: C14H13BrN4O2S2 MolecularWeight: 413.31262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=NC(=N2)NS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=NC(=N2)NS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C14H13BrN4O2S2/c1-10-2-4-11(5-3-10)8-19-9-16-14(17-19)18-23(20,21)13-7-6-12(15)22-13/h2-7,9H,8H2,1H3,(H,17,18)