S-[2-oxidanylidene-2-[6-[[4-(3-piperidin-1-ylpropoxy)phenyl]sulfonylamino]pyridin-3-yl]ethyl] ethanethioate

Systemtic Name: S-[2-oxidanylidene-2-[6-[[4-(3-piperidin-1-ylpropoxy)phenyl]sulfonylamino]pyridin-3-yl]ethyl] ethanethioate Openeye Name: S-[2-oxo-2-[6-[[4-[3-(1-piperidyl)propoxy]phenyl]sulfonylamino]-3-pyridyl]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-[6-[[4-[3-(1-piperidinyl)propoxy]phenyl]sulfonylamino]-3-pyridinyl]ethyl] ester IUPAC Name: S-[2-oxo-2-[6-[[4-(3-piperidin-1-ylpropoxy)phenyl]sulfonylamino]pyridin-3-yl]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[6-[[4-(3-piperidinopropoxy)phenyl]sulfonylamino]-3-pyridyl]ethyl] ester Formula: C23H29N3O5S2 MolecularWeight: 491.62346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OCCCN3CCCCC3

Isomeric SMILES

CC(=O)SCC(=O)C1=CN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OCCCN3CCCCC3

InChI

InChI=1S/C23H29N3O5S2/c1-18(27)32-17-22(28)19-6-11-23(24-16-19)25-33(29,30)21-9-7-20(8-10-21)31-15-5-14-26-12-3-2-4-13-26/h6-11,16H,2-5,12-15,17H2,1H3,(H,24,25)