N-[[4-(2-azanylethylamino)-3-methoxy-phenyl]methylsulfanyl]nonanamide

Systemtic Name: N-[[4-(2-azanylethylamino)-3-methoxy-phenyl]methylsulfanyl]nonanamide Openeye Name: N-[[4-(2-aminoethylamino)-3-methoxy-phenyl]methylsulfanyl]nonanamide CAS Name: N-[[4-(2-aminoethylamino)-3-methoxyphenyl]methylthio]nonanamide IUPAC Name: N-[[4-(2-aminoethylamino)-3-methoxyphenyl]methylsulfanyl]nonanamide Traditional Name: N-[[4-(2-aminoethylamino)-3-methoxy-benzyl]thio]pelargonamide Formula: C19H33N3O2S MolecularWeight: 367.54922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NSCC1=CC(=C(C=C1)NCCN)OC

Isomeric SMILES

CCCCCCCCC(=O)NSCC1=CC(=C(C=C1)NCCN)OC

InChI

InChI=1S/C19H33N3O2S/c1-3-4-5-6-7-8-9-19(23)22-25-15-16-10-11-17(21-13-12-20)18(14-16)24-2/h10-11,14,21H,3-9,12-13,15,20H2,1-2H3,(H,22,23)