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

Systemtic Name: N-(2-methoxyphenyl)-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]sulfanyl-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-N-(2-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide CAS Name: N-(2-methoxyphenyl)-2-[[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]thio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl-N-(2-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[2-(4-benzylpiperazino)-2-keto-ethyl]thio]-N-(2-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Formula: C27H28N4O5S2 MolecularWeight: 552.66502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H28N4O5S2/c1-35-24-10-6-5-9-22(24)29-38(33,34)21-11-12-25-23(17-21)28-27(36-25)37-19-26(32)31-15-13-30(14-16-31)18-20-7-3-2-4-8-20/h2-12,17,29H,13-16,18-19H2,1H3