methyl 4-[2-(2-methoxyphenyl)ethylcarbamothioylamino]butanoate

Systemtic Name: methyl 4-[2-(2-methoxyphenyl)ethylcarbamothioylamino]butanoate Openeye Name: methyl 4-[2-(2-methoxyphenyl)ethylcarbamothioylamino]butanoate CAS Name: 4-[[[2-(2-methoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[2-(2-methoxyphenyl)ethylcarbamothioylamino]butanoate Traditional Name: 4-[2-(2-methoxyphenyl)ethylthiocarbamoylamino]butyric acid methyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC(=S)NCCCC(=O)OC

Isomeric SMILES

COC1=CC=CC=C1CCNC(=S)NCCCC(=O)OC

InChI

InChI=1S/C15H22N2O3S/c1-19-13-7-4-3-6-12(13)9-11-17-15(21)16-10-5-8-14(18)20-2/h3-4,6-7H,5,8-11H2,1-2H3,(H2,16,17,21)