ethyl (3S)-3-[[(1R)-2-oxidanyl-1-phenyl-ethyl]-(phenylmethyl)amino]-3-thiophen-2-yl-propanoate

Systemtic Name: ethyl (3S)-3-[[(1R)-2-oxidanyl-1-phenyl-ethyl]-(phenylmethyl)amino]-3-thiophen-2-yl-propanoate Openeye Name: ethyl (3S)-3-[benzyl-[(1R)-2-hydroxy-1-phenyl-ethyl]amino]-3-(2-thienyl)propanoate CAS Name: (3S)-3-[[(1R)-2-hydroxy-1-phenylethyl]-(phenylmethyl)amino]-3-thiophen-2-ylpropanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[benzyl-[(1R)-2-hydroxy-1-phenylethyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: (3S)-3-[benzyl-[(1R)-2-hydroxy-1-phenyl-ethyl]amino]-3-(2-thienyl)propionic acid ethyl ester Formula: C24H27NO3S MolecularWeight: 409.54108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CS1)N(CC2=CC=CC=C2)C(CO)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C[C@@H](C1=CC=CS1)N(CC2=CC=CC=C2)[C@@H](CO)C3=CC=CC=C3

InChI

InChI=1S/C24H27NO3S/c1-2-28-24(27)16-21(23-14-9-15-29-23)25(17-19-10-5-3-6-11-19)22(18-26)20-12-7-4-8-13-20/h3-15,21-22,26H,2,16-18H2,1H3/t21-,22-/m0/s1