methyl (3S)-3-(4-chlorophenyl)-3-(4-thiophen-2-ylbutanoylamino)propanoate

Systemtic Name: methyl (3S)-3-(4-chlorophenyl)-3-(4-thiophen-2-ylbutanoylamino)propanoate Openeye Name: methyl (3S)-3-(4-chlorophenyl)-3-[4-(2-thienyl)butanoylamino]propanoate CAS Name: (3S)-3-(4-chlorophenyl)-3-[(1-oxo-4-thiophen-2-ylbutyl)amino]propanoic acid methyl ester IUPAC Name: methyl (3S)-3-(4-chlorophenyl)-3-(4-thiophen-2-ylbutanoylamino)propanoate Traditional Name: (3S)-3-(4-chlorophenyl)-3-[4-(2-thienyl)butanoylamino]propionic acid methyl ester Formula: C18H20ClNO3S MolecularWeight: 365.8743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)Cl)NC(=O)CCCC2=CC=CS2

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=C(C=C1)Cl)NC(=O)CCCC2=CC=CS2

InChI

InChI=1S/C18H20ClNO3S/c1-23-18(22)12-16(13-7-9-14(19)10-8-13)20-17(21)6-2-4-15-5-3-11-24-15/h3,5,7-11,16H,2,4,6,12H2,1H3,(H,20,21)/t16-/m0/s1