N-[[3-(2-azanylethyl)-5-methoxy-4-sulfanyl-phenyl]methylsulfanyl]nonanamide

Systemtic Name: N-[[3-(2-azanylethyl)-5-methoxy-4-sulfanyl-phenyl]methylsulfanyl]nonanamide Openeye Name: N-[[3-(2-aminoethyl)-5-methoxy-4-sulfanyl-phenyl]methylsulfanyl]nonanamide CAS Name: N-[[3-(2-aminoethyl)-4-mercapto-5-methoxyphenyl]methylthio]nonanamide IUPAC Name: N-[[3-(2-aminoethyl)-5-methoxy-4-sulfanylphenyl]methylsulfanyl]nonanamide Traditional Name: N-[[3-(2-aminoethyl)-4-mercapto-5-methoxy-benzyl]thio]pelargonamide Formula: C19H32N2O2S2 MolecularWeight: 384.59958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NSCC1=CC(=C(C(=C1)OC)S)CCN

Isomeric SMILES

CCCCCCCCC(=O)NSCC1=CC(=C(C(=C1)OC)S)CCN

InChI

InChI=1S/C19H32N2O2S2/c1-3-4-5-6-7-8-9-18(22)21-25-14-15-12-16(10-11-20)19(24)17(13-15)23-2/h12-13,24H,3-11,14,20H2,1-2H3,(H,21,22)