2-[3-(phenylmethyl)furan-2-yl]-2-(sulfanylmethylamino)ethanoic acid

Systemtic Name: 2-[3-(phenylmethyl)furan-2-yl]-2-(sulfanylmethylamino)ethanoic acid Openeye Name: 2-(3-benzyl-2-furyl)-2-(sulfanylmethylamino)acetic acid CAS Name: 2-(mercaptomethylamino)-2-[3-(phenylmethyl)-2-furanyl]acetic acid IUPAC Name: 2-(3-benzylfuran-2-yl)-2-(sulfanylmethylamino)acetic acid Traditional Name: 2-(3-benzyl-2-furyl)-2-(mercaptomethylamino)acetic acid Formula: C14H15NO3S MolecularWeight: 277.3388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(OC=C2)C(C(=O)O)NCS

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(OC=C2)C(C(=O)O)NCS

InChI

InChI=1S/C14H15NO3S/c16-14(17)12(15-9-19)13-11(6-7-18-13)8-10-4-2-1-3-5-10/h1-7,12,15,19H,8-9H2,(H,16,17)