tert-butyl 4-[2-methoxy-1-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-2-oxidanylidene-ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-methoxy-1-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-2-oxidanylidene-ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-methoxy-1-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-2-oxo-ethyl]piperidine-1-carboxylate CAS Name: 4-[2-methoxy-1-[[4-[4-(methylthio)phenyl]phenyl]sulfonylamino]-2-oxoethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-methoxy-1-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-2-oxoethyl]piperidine-1-carboxylate Traditional Name: 4-[2-keto-2-methoxy-1-[[4-[4-(methylthio)phenyl]phenyl]sulfonylamino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H34N2O6S2 MolecularWeight: 534.68796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)SC

InChI

InChI=1S/C26H34N2O6S2/c1-26(2,3)34-25(30)28-16-14-20(15-17-28)23(24(29)33-4)27-36(31,32)22-12-8-19(9-13-22)18-6-10-21(35-5)11-7-18/h6-13,20,23,27H,14-17H2,1-5H3