N-[1-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-2-methyl-propan-2-yl]-4-chloranyl-benzenesulfonamide

Systemtic Name: N-[1-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-2-methyl-propan-2-yl]-4-chloranyl-benzenesulfonamide Openeye Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1,1-dimethyl-ethyl]-4-chloro-benzenesulfonamide CAS Name: N-[1-[(4-amino-1,2,4-triazol-3-yl)thio]-2-methylpropan-2-yl]-4-chlorobenzenesulfonamide IUPAC Name: N-[1-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-2-methylpropan-2-yl]-4-chlorobenzenesulfonamide Traditional Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)thio]-1,1-dimethyl-ethyl]-4-chloro-benzenesulfonamide Formula: C12H16ClN5O2S2 MolecularWeight: 361.87074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CSC1=NN=CN1N)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(CSC1=NN=CN1N)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H16ClN5O2S2/c1-12(2,7-21-11-16-15-8-18(11)14)17-22(19,20)10-5-3-9(13)4-6-10/h3-6,8,17H,7,14H2,1-2H3