5-methoxy-3-oxidanyl-N-[2-[4-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperazin-1-yl]ethyl]naphthalene-2-carboxamide

Systemtic Name: 5-methoxy-3-oxidanyl-N-[2-[4-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperazin-1-yl]ethyl]naphthalene-2-carboxamide Openeye Name: 3-hydroxy-5-methoxy-N-[2-[4-[2-(2-thienylmethylsulfanyl)ethyl]piperazin-1-yl]ethyl]naphthalene-2-carboxamide CAS Name: 3-hydroxy-5-methoxy-N-[2-[4-[2-(thiophen-2-ylmethylthio)ethyl]-1-piperazinyl]ethyl]-2-naphthalenecarboxamide IUPAC Name: 3-hydroxy-5-methoxy-N-[2-[4-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperazin-1-yl]ethyl]naphthalene-2-carboxamide Traditional Name: 3-hydroxy-5-methoxy-N-[2-[4-[2-(2-thenylthio)ethyl]piperazino]ethyl]-2-naphthamide Formula: C25H31N3O3S2 MolecularWeight: 485.66194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=CC(=C(C=C21)O)C(=O)NCCN3CCN(CC3)CCSCC4=CC=CS4

Isomeric SMILES

COC1=CC=CC2=CC(=C(C=C21)O)C(=O)NCCN3CCN(CC3)CCSCC4=CC=CS4

InChI

InChI=1S/C25H31N3O3S2/c1-31-24-6-2-4-19-16-22(23(29)17-21(19)24)25(30)26-7-8-27-9-11-28(12-10-27)13-15-32-18-20-5-3-14-33-20/h2-6,14,16-17,29H,7-13,15,18H2,1H3,(H,26,30)