propan-2-yl 3-[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: propan-2-yl 3-[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoylamino]-3-(4-methylphenyl)propanoate Openeye Name: isopropyl 3-[[2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetyl]amino]-3-(p-tolyl)propanoate CAS Name: 3-[[2-[(4-chlorophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]-3-(4-methylphenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-[(4-chlorophenyl)sulfonyl-methylamino]acetyl]amino]-3-(4-methylphenyl)propanoate Traditional Name: 3-[[2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetyl]amino]-3-(p-tolyl)propionic acid isopropyl ester Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H27ClN2O5S/c1-15(2)30-22(27)13-20(17-7-5-16(3)6-8-17)24-21(26)14-25(4)31(28,29)19-11-9-18(23)10-12-19/h5-12,15,20H,13-14H2,1-4H3,(H,24,26)