3-(2-aminophenyl)sulfanyl-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(2-aminophenyl)sulfanyl-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 3-(2-aminophenyl)sulfanyl-2-(benzyloxycarbonylamino)propanoic acid CAS Name: 3-[(2-aminophenyl)thio]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(2-aminophenyl)sulfanyl-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-[(2-aminophenyl)thio]-2-(benzyloxycarbonylamino)propionic acid Formula: C17H18N2O4S MolecularWeight: 346.40082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CSC2=CC=CC=C2N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CSC2=CC=CC=C2N)C(=O)O

InChI

InChI=1S/C17H18N2O4S/c18-13-8-4-5-9-15(13)24-11-14(16(20)21)19-17(22)23-10-12-6-2-1-3-7-12/h1-9,14H,10-11,18H2,(H,19,22)(H,20,21)