N-(4-methoxyphenyl)-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N-(4-methoxyphenyl)-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide CAS Name: N-(4-methoxyphenyl)-2-[[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]thio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[2-(4-benzylpiperidino)-2-keto-ethyl]thio]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Formula: C28H29N3O5S2 MolecularWeight: 551.67696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O5S2/c1-35-23-9-7-22(8-10-23)30-38(33,34)24-11-12-26-25(18-24)29-28(36-26)37-19-27(32)31-15-13-21(14-16-31)17-20-5-3-2-4-6-20/h2-12,18,21,30H,13-17,19H2,1H3