2-azanyl-5-[(2-chlorophenyl)methylsulfanyl]pentanoic acid

Systemtic Name: 2-azanyl-5-[(2-chlorophenyl)methylsulfanyl]pentanoic acid Openeye Name: 2-amino-5-[(2-chlorophenyl)methylsulfanyl]pentanoic acid CAS Name: 2-amino-5-[(2-chlorophenyl)methylthio]pentanoic acid IUPAC Name: 2-amino-5-[(2-chlorophenyl)methylsulfanyl]pentanoic acid Traditional Name: 2-amino-5-[(2-chlorobenzyl)thio]valeric acid Formula: C12H16ClNO2S MolecularWeight: 273.77894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCCC(C(=O)O)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSCCCC(C(=O)O)N)Cl

InChI

InChI=1S/C12H16ClNO2S/c13-10-5-2-1-4-9(10)8-17-7-3-6-11(14)12(15)16/h1-2,4-5,11H,3,6-8,14H2,(H,15,16)