[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid [2-keto-1-methyl-2-(p-anisylamino)ethyl] ester Formula: C20H22ClNO4S MolecularWeight: 407.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)OC)OC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)OC)OC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H22ClNO4S/c1-14(20(24)22-13-15-3-7-17(25-2)8-4-15)26-19(23)11-12-27-18-9-5-16(21)6-10-18/h3-10,14H,11-13H2,1-2H3,(H,22,24)