2-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]thio]acetic acid IUPAC Name: 2-[2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[benzyl(2-thenyl)amino]-2-keto-ethyl]thio]acetic acid Formula: C16H17NO3S2 MolecularWeight: 335.44108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CS2)C(=O)CSCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CS2)C(=O)CSCC(=O)O

InChI

InChI=1S/C16H17NO3S2/c18-15(11-21-12-16(19)20)17(10-14-7-4-8-22-14)9-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,19,20)