methyl (Z,8R)-8-[(phenylmethyl)amino]-9-(phenylmethylsulfanyl)non-6-enoate

Systemtic Name: methyl (Z,8R)-8-[(phenylmethyl)amino]-9-(phenylmethylsulfanyl)non-6-enoate Openeye Name: methyl (Z,8R)-8-(benzylamino)-9-benzylsulfanyl-non-6-enoate CAS Name: (Z,8R)-8-[(phenylmethyl)amino]-9-(phenylmethylthio)-6-nonenoic acid methyl ester IUPAC Name: methyl (Z,8R)-8-(benzylamino)-9-benzylsulfanylnon-6-enoate Traditional Name: (Z,8R)-8-(benzylamino)-9-(benzylthio)non-6-enoic acid methyl ester Formula: C24H31NO2S MolecularWeight: 397.57344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC=CC(CSCC1=CC=CC=C1)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCC/C=C\[C@H](CSCC1=CC=CC=C1)NCC2=CC=CC=C2

InChI

InChI=1S/C24H31NO2S/c1-27-24(26)17-11-3-2-10-16-23(25-18-21-12-6-4-7-13-21)20-28-19-22-14-8-5-9-15-22/h4-10,12-16,23,25H,2-3,11,17-20H2,1H3/b16-10-/t23-/m1/s1