4-chloranyl-5-methyl-N-[5-(naphthalen-2-ylamino)-1H-1,2,4-triazol-3-yl]-2-sulfanyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-5-methyl-N-[5-(naphthalen-2-ylamino)-1H-1,2,4-triazol-3-yl]-2-sulfanyl-benzenesulfonamide Openeye Name: 4-chloro-5-methyl-N-[5-(2-naphthylamino)-1H-1,2,4-triazol-3-yl]-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-2-mercapto-5-methyl-N-[5-(2-naphthalenylamino)-1H-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: 4-chloro-5-methyl-N-[5-(naphthalen-2-ylamino)-1H-1,2,4-triazol-3-yl]-2-sulfanylbenzenesulfonamide Traditional Name: 4-chloro-2-mercapto-5-methyl-N-[5-(2-naphthylamino)-1H-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C19H16ClN5O2S2 MolecularWeight: 445.94564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NNC(=N2)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NNC(=N2)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C19H16ClN5O2S2/c1-11-8-17(16(28)10-15(11)20)29(26,27)25-19-22-18(23-24-19)21-14-7-6-12-4-2-3-5-13(12)9-14/h2-10,28H,1H3,(H3,21,22,23,24,25)