N,N-diethyl-3-[5-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[5-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[5-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide CAS Name: N,N-diethyl-3-[5-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[5-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[5-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-4-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide Formula: C29H29N5O3S2 MolecularWeight: 559.70226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=C(NC5=CC=CC=C54)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=C(NC5=CC=CC=C54)C

InChI

InChI=1S/C29H29N5O3S2/c1-4-33(5-2)39(36,37)23-15-11-12-21(18-23)28-31-32-29(34(28)22-13-7-6-8-14-22)38-19-26(35)27-20(3)30-25-17-10-9-16-24(25)27/h6-18,30H,4-5,19H2,1-3H3