2-[2-(4-methoxyphenyl)ethylcarbamoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-(4-methoxyphenyl)ethylcarbamoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[2-(4-methoxyphenyl)ethylcarbamoylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[2-(4-methoxyphenyl)ethylamino]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[2-(4-methoxyphenyl)ethylcarbamoylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[2-(4-methoxyphenyl)ethylcarbamoylamino]-4-(methylthio)butyric acid Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C15H22N2O4S/c1-21-12-5-3-11(4-6-12)7-9-16-15(20)17-13(14(18)19)8-10-22-2/h3-6,13H,7-10H2,1-2H3,(H,18,19)(H2,16,17,20)