N-[2-(2-methylpyridin-4-yl)-6-oxidanyl-phenyl]-13-sulfanyl-tridecanamide

Systemtic Name: N-[2-(2-methylpyridin-4-yl)-6-oxidanyl-phenyl]-13-sulfanyl-tridecanamide Openeye Name: N-[2-hydroxy-6-(2-methyl-4-pyridyl)phenyl]-13-sulfanyl-tridecanamide CAS Name: N-[2-hydroxy-6-(2-methyl-4-pyridinyl)phenyl]-13-mercaptotridecanamide IUPAC Name: N-[2-hydroxy-6-(2-methylpyridin-4-yl)phenyl]-13-sulfanyltridecanamide Traditional Name: N-[2-hydroxy-6-(2-methyl-4-pyridyl)phenyl]-13-mercapto-tridecanamide Formula: C25H36N2O2S MolecularWeight: 428.63054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=C(C(=CC=C2)O)NC(=O)CCCCCCCCCCCCS

Isomeric SMILES

CC1=NC=CC(=C1)C2=C(C(=CC=C2)O)NC(=O)CCCCCCCCCCCCS

InChI

InChI=1S/C25H36N2O2S/c1-20-19-21(16-17-26-20)22-13-12-14-23(28)25(22)27-24(29)15-10-8-6-4-2-3-5-7-9-11-18-30/h12-14,16-17,19,28,30H,2-11,15,18H2,1H3,(H,27,29)