methyl (3S)-3-[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (3S)-3-[[5-(4-fluorophenyl)thiophen-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (3S)-3-[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[[5-(4-fluorophenyl)-2-thiophenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]-3-phenylpropanoate Traditional Name: (3S)-3-[[5-(4-fluorophenyl)thiophene-2-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H18FNO3S MolecularWeight: 383.435923

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FNO3S/c1-26-20(24)13-17(14-5-3-2-4-6-14)23-21(25)19-12-11-18(27-19)15-7-9-16(22)10-8-15/h2-12,17H,13H2,1H3,(H,23,25)/t17-/m0/s1