methyl 2-[2-[(4-chlorophenyl)-phenyl-methyl]sulfanylethanoylamino]-2-methyl-propanoate

Systemtic Name: methyl 2-[2-[(4-chlorophenyl)-phenyl-methyl]sulfanylethanoylamino]-2-methyl-propanoate Openeye Name: methyl 2-[[2-[(4-chlorophenyl)-phenyl-methyl]sulfanylacetyl]amino]-2-methyl-propanoate CAS Name: 2-[[2-[[(4-chlorophenyl)-phenylmethyl]thio]-1-oxoethyl]amino]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-chlorophenyl)-phenylmethyl]sulfanylacetyl]amino]-2-methylpropanoate Traditional Name: 2-[[2-[[(4-chlorophenyl)-phenyl-methyl]thio]acetyl]amino]-2-methyl-propionic acid methyl ester Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)CSC(C1=CC=CC=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)CSC(C1=CC=CC=C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H22ClNO3S/c1-20(2,19(24)25-3)22-17(23)13-26-18(14-7-5-4-6-8-14)15-9-11-16(21)12-10-15/h4-12,18H,13H2,1-3H3,(H,22,23)