methyl (Z)-3-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylethylamino)prop-2-enoate

Systemtic Name: methyl (Z)-3-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylethylamino)prop-2-enoate Openeye Name: methyl (Z)-3-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylethylamino)prop-2-enoate CAS Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[2-(phenylthio)ethylamino]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(3,4-dimethoxyphenyl)-3-(2-phenylsulfanylethylamino)prop-2-enoate Traditional Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[2-(phenylthio)ethylamino]acrylic acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC(=O)OC)NCCSC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C(=O)OC)/NCCSC2=CC=CC=C2)OC

InChI

InChI=1S/C20H23NO4S/c1-23-18-10-9-15(13-19(18)24-2)17(14-20(22)25-3)21-11-12-26-16-7-5-4-6-8-16/h4-10,13-14,21H,11-12H2,1-3H3/b17-14-