2-[(1-ethanoylsulfanyl-3-phenyl-propan-2-yl)carbamoylamino]ethanoic acid

Systemtic Name: 2-[(1-ethanoylsulfanyl-3-phenyl-propan-2-yl)carbamoylamino]ethanoic acid Openeye Name: 2-[[1-(acetylsulfanylmethyl)-2-phenyl-ethyl]carbamoylamino]acetic acid CAS Name: 2-[[[[1-(acetylthio)-3-phenylpropan-2-yl]amino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(1-acetylsulfanyl-3-phenylpropan-2-yl)carbamoylamino]acetic acid Traditional Name: 2-[[1-[(acetylthio)methyl]-2-phenyl-ethyl]carbamoylamino]acetic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CC=CC=C1)NC(=O)NCC(=O)O

Isomeric SMILES

CC(=O)SCC(CC1=CC=CC=C1)NC(=O)NCC(=O)O

InChI

InChI=1S/C14H18N2O4S/c1-10(17)21-9-12(7-11-5-3-2-4-6-11)16-14(20)15-8-13(18)19/h2-6,12H,7-9H2,1H3,(H,18,19)(H2,15,16,20)