methyl 3-(2-aminophenyl)sulfanyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-(2-aminophenyl)sulfanyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 3-(2-aminophenyl)sulfanyl-2-(benzyloxycarbonylamino)propanoate CAS Name: 3-[(2-aminophenyl)thio]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-(2-aminophenyl)sulfanyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-[(2-aminophenyl)thio]-2-(benzyloxycarbonylamino)propionic acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CSC1=CC=CC=C1N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CSC1=CC=CC=C1N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4S/c1-23-17(21)15(12-25-16-10-6-5-9-14(16)19)20-18(22)24-11-13-7-3-2-4-8-13/h2-10,15H,11-12,19H2,1H3,(H,20,22)