N,N-diethyl-3-[5-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[5-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: 3-[4-benzyl-5-[2-(2-naphthyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide CAS Name: N,N-diethyl-3-[5-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-4-(phenylmethyl)-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: 3-[4-benzyl-5-(2-naphthalen-2-yl-2-oxoethyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[4-benzyl-5-[[2-keto-2-(2-naphthyl)ethyl]thio]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C31H30N4O3S2 MolecularWeight: 570.7249

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H30N4O3S2/c1-3-34(4-2)40(37,38)28-16-10-15-27(20-28)30-32-33-31(35(30)21-23-11-6-5-7-12-23)39-22-29(36)26-18-17-24-13-8-9-14-25(24)19-26/h5-20H,3-4,21-22H2,1-2H3