propan-2-yl 3-(2-chlorophenyl)-3-(2,3-dihydro-1-benzothiophen-2-ylcarbonylamino)propanoate

Systemtic Name: propan-2-yl 3-(2-chlorophenyl)-3-(2,3-dihydro-1-benzothiophen-2-ylcarbonylamino)propanoate Openeye Name: isopropyl 3-(2-chlorophenyl)-3-(2,3-dihydrobenzothiophene-2-carbonylamino)propanoate CAS Name: 3-(2-chlorophenyl)-3-[[2,3-dihydro-1-benzothiophen-2-yl(oxo)methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-chlorophenyl)-3-(2,3-dihydro-1-benzothiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-chlorophenyl)-3-(2,3-dihydrobenzothiophene-2-carbonylamino)propionic acid isopropyl ester Formula: C21H22ClNO3S MolecularWeight: 403.92228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2CC3=CC=CC=C3S2

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2CC3=CC=CC=C3S2

InChI

InChI=1S/C21H22ClNO3S/c1-13(2)26-20(24)12-17(15-8-4-5-9-16(15)22)23-21(25)19-11-14-7-3-6-10-18(14)27-19/h3-10,13,17,19H,11-12H2,1-2H3,(H,23,25)