3-naphthalen-2-yl-2-(propan-2-ylsulfanylcarbamoylamino)propanoic acid

Systemtic Name: 3-naphthalen-2-yl-2-(propan-2-ylsulfanylcarbamoylamino)propanoic acid Openeye Name: 2-(isopropylsulfanylcarbamoylamino)-3-(2-naphthyl)propanoic acid CAS Name: 3-(2-naphthalenyl)-2-[[oxo-[(propan-2-ylthio)amino]methyl]amino]propanoic acid IUPAC Name: 3-naphthalen-2-yl-2-(propan-2-ylsulfanylcarbamoylamino)propanoic acid Traditional Name: 2-[(isopropylthio)carbamoylamino]-3-(2-naphthyl)propionic acid Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SNC(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

CC(C)SNC(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O

InChI

InChI=1S/C17H20N2O3S/c1-11(2)23-19-17(22)18-15(16(20)21)10-12-7-8-13-5-3-4-6-14(13)9-12/h3-9,11,15H,10H2,1-2H3,(H,20,21)(H2,18,19,22)