2-[cyclopropylmethyl(2-phenethylsulfanylethanoyl)amino]ethanoic acid

Systemtic Name: 2-[cyclopropylmethyl(2-phenethylsulfanylethanoyl)amino]ethanoic acid Openeye Name: 2-[cyclopropylmethyl-(2-phenethylsulfanylacetyl)amino]acetic acid CAS Name: 2-[cyclopropylmethyl-[1-oxo-2-(phenethylthio)ethyl]amino]acetic acid IUPAC Name: 2-[cyclopropylmethyl-(2-phenethylsulfanylacetyl)amino]acetic acid Traditional Name: 2-[cyclopropylmethyl-[2-(phenethylthio)acetyl]amino]acetic acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC(=O)O)C(=O)CSCCC2=CC=CC=C2

Isomeric SMILES

C1CC1CN(CC(=O)O)C(=O)CSCCC2=CC=CC=C2

InChI

InChI=1S/C16H21NO3S/c18-15(17(11-16(19)20)10-14-6-7-14)12-21-9-8-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,19,20)