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

Systemtic Name: N-ethyl-3,5-bis(oxidanyl)-N-[4-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperazin-1-yl]naphthalene-2-carboxamide Openeye Name: N-ethyl-3,5-dihydroxy-N-[4-[2-(2-thienylmethylsulfanyl)ethyl]piperazin-1-yl]naphthalene-2-carboxamide CAS Name: N-ethyl-3,5-dihydroxy-N-[4-[2-(thiophen-2-ylmethylthio)ethyl]-1-piperazinyl]-2-naphthalenecarboxamide IUPAC Name: N-ethyl-3,5-dihydroxy-N-[4-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperazin-1-yl]naphthalene-2-carboxamide Traditional Name: N-ethyl-3,5-dihydroxy-N-[4-[2-(2-thenylthio)ethyl]piperazino]-2-naphthamide Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=C(C=C2C(=C1)C=CC=C2O)O)N3CCN(CC3)CCSCC4=CC=CS4

Isomeric SMILES

CCN(C(=O)C1=C(C=C2C(=C1)C=CC=C2O)O)N3CCN(CC3)CCSCC4=CC=CS4

InChI

InChI=1S/C24H29N3O3S2/c1-2-27(24(30)21-15-18-5-3-7-22(28)20(18)16-23(21)29)26-10-8-25(9-11-26)12-14-31-17-19-6-4-13-32-19/h3-7,13,15-16,28-29H,2,8-12,14,17H2,1H3