[2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)sulfanylbutanoate

Systemtic Name: [2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)sulfanylbutanoate Openeye Name: [2-(2-methoxyethylcarbamoylamino)-2-oxo-ethyl] 4-(4-chlorophenyl)sulfanylbutanoate CAS Name: 4-[(4-chlorophenyl)thio]butanoic acid [2-[[(2-methoxyethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylcarbamoylamino)-2-oxoethyl] 4-(4-chlorophenyl)sulfanylbutanoate Traditional Name: 4-[(4-chlorophenyl)thio]butyric acid [2-keto-2-(2-methoxyethylcarbamoylamino)ethyl] ester Formula: C16H21ClN2O5S MolecularWeight: 388.86634

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)NC(=O)COC(=O)CCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

COCCNC(=O)NC(=O)COC(=O)CCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H21ClN2O5S/c1-23-9-8-18-16(22)19-14(20)11-24-15(21)3-2-10-25-13-6-4-12(17)5-7-13/h4-7H,2-3,8-11H2,1H3,(H2,18,19,20,22)