methyl 2-[[[2-oxidanyl-3-(2-prop-2-enoxyphenoxy)propyl]-propan-2-yl-carbamothioyl]amino]benzoate

Systemtic Name: methyl 2-[[[2-oxidanyl-3-(2-prop-2-enoxyphenoxy)propyl]-propan-2-yl-carbamothioyl]amino]benzoate Openeye Name: methyl 2-[[[3-(2-allyloxyphenoxy)-2-hydroxy-propyl]-isopropyl-carbamothioyl]amino]benzoate CAS Name: 2-[[[[2-hydroxy-3-(2-prop-2-enoxyphenoxy)propyl]-propan-2-ylamino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[[2-hydroxy-3-(2-prop-2-enoxyphenoxy)propyl]-propan-2-ylcarbamothioyl]amino]benzoate Traditional Name: 2-[[[3-(2-allyloxyphenoxy)-2-hydroxy-propyl]-isopropyl-thiocarbamoyl]amino]benzoic acid methyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(COC1=CC=CC=C1OCC=C)O)C(=S)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC(C)N(CC(COC1=CC=CC=C1OCC=C)O)C(=S)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C24H30N2O5S/c1-5-14-30-21-12-8-9-13-22(21)31-16-18(27)15-26(17(2)3)24(32)25-20-11-7-6-10-19(20)23(28)29-4/h5-13,17-18,27H,1,14-16H2,2-4H3,(H,25,32)