ethyl 4-[2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[[(R)-phenyl(2-thienyl)methyl]amino]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[[(R)-phenyl(2-thienyl)methyl]amino]acetyl]amino]benzoic acid ethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CNC(C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN[C@H](C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C22H22N2O3S/c1-2-27-22(26)17-10-12-18(13-11-17)24-20(25)15-23-21(19-9-6-14-28-19)16-7-4-3-5-8-16/h3-14,21,23H,2,15H2,1H3,(H,24,25)/t21-/m1/s1