2-[cyclopropylmethyl-[3-(4-fluorophenyl)sulfanylpropanoyl]amino]ethanoic acid

Systemtic Name: 2-[cyclopropylmethyl-[3-(4-fluorophenyl)sulfanylpropanoyl]amino]ethanoic acid Openeye Name: 2-[cyclopropylmethyl-[3-(4-fluorophenyl)sulfanylpropanoyl]amino]acetic acid CAS Name: 2-[cyclopropylmethyl-[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[cyclopropylmethyl-[3-(4-fluorophenyl)sulfanylpropanoyl]amino]acetic acid Traditional Name: 2-[cyclopropylmethyl-[3-[(4-fluorophenyl)thio]propanoyl]amino]acetic acid Formula: C15H18FNO3S MolecularWeight: 311.371723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC(=O)O)C(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

C1CC1CN(CC(=O)O)C(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C15H18FNO3S/c16-12-3-5-13(6-4-12)21-8-7-14(18)17(10-15(19)20)9-11-1-2-11/h3-6,11H,1-2,7-10H2,(H,19,20)