N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[5-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[[5-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[5-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[[5-[(2-indolin-1-yl-2-keto-ethyl)thio]-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-piperidinosulfonyl-benzamide Formula: C32H34N6O5S2 MolecularWeight: 646.77956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=C2SCC(=O)N3CCC4=CC=CC=C43)CNC(=O)C5=CC=C(C=C5)S(=O)(=O)N6CCCCC6

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=C2SCC(=O)N3CCC4=CC=CC=C43)CNC(=O)C5=CC=C(C=C5)S(=O)(=O)N6CCCCC6

InChI

InChI=1S/C32H34N6O5S2/c1-43-28-12-6-5-11-27(28)38-29(34-35-32(38)44-22-30(39)37-20-17-23-9-3-4-10-26(23)37)21-33-31(40)24-13-15-25(16-14-24)45(41,42)36-18-7-2-8-19-36/h3-6,9-16H,2,7-8,17-22H2,1H3,(H,33,40)