2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoyl-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoyl-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[[2-[(3-chlorobenzyl)thio]acetyl]-(cyclopropylmethyl)amino]acetic acid Formula: C15H18ClNO3S MolecularWeight: 327.82632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CC(=O)O)C(=O)CSCC2=CC(=CC=C2)Cl

Isomeric SMILES

C1CC1CN(CC(=O)O)C(=O)CSCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H18ClNO3S/c16-13-3-1-2-12(6-13)9-21-10-14(18)17(8-15(19)20)7-11-4-5-11/h1-3,6,11H,4-5,7-10H2,(H,19,20)