methyl 2-[(phenylmethyl)amino]-3-phenylsulfanyl-propanoate

Systemtic Name: methyl 2-[(phenylmethyl)amino]-3-phenylsulfanyl-propanoate Openeye Name: methyl 2-(benzylamino)-3-phenylsulfanyl-propanoate CAS Name: 2-[(phenylmethyl)amino]-3-(phenylthio)propanoic acid methyl ester IUPAC Name: methyl 2-(benzylamino)-3-phenylsulfanylpropanoate Traditional Name: 2-(benzylamino)-3-(phenylthio)propionic acid methyl ester Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CSC1=CC=CC=C1)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CSC1=CC=CC=C1)NCC2=CC=CC=C2

InChI

InChI=1S/C17H19NO2S/c1-20-17(19)16(13-21-15-10-6-3-7-11-15)18-12-14-8-4-2-5-9-14/h2-11,16,18H,12-13H2,1H3