(2S)-2-[(azanyl-oxidanylidene-phenethyl-$l^{6}-sulfanylidene)amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[(azanyl-oxidanylidene-phenethyl-$l^{6}-sulfanylidene)amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[(amino-oxo-phenethyl-$l^{6}-sulfanylidene)amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[(amino-oxo-phenethyl-$l^{6}-sulfanylidene)amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(amino-oxo-phenethyl-$l^{6}-sulfanylidene)amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[(amino-keto-phenethyl-persulfuranylidene)amino]-3-phenyl-propionic acid Formula: C17H20N2O3S MolecularWeight: 332.4173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCS(=NC(CC2=CC=CC=C2)C(=O)O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CCS(=N[C@@H](CC2=CC=CC=C2)C(=O)O)(=O)N

InChI

InChI=1S/C17H20N2O3S/c18-23(22,12-11-14-7-3-1-4-8-14)19-16(17(20)21)13-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,20,21)(H2,18,19,22)/t16-,23?/m0/s1