2-(ethylsulfanylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-(ethylsulfanylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-(ethylsulfanylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[[(ethylthio)amino]-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-(ethylsulfanylcarbamoylamino)-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[(ethylthio)carbamoylamino]-3-(4-hydroxyphenyl)propionic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CCSNC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

CCSNC(=O)NC(CC1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C12H16N2O4S/c1-2-19-14-12(18)13-10(11(16)17)7-8-3-5-9(15)6-4-8/h3-6,10,15H,2,7H2,1H3,(H,16,17)(H2,13,14,18)