2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]-2-cyclopropyl-propanoic acid

Systemtic Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]ethanoylamino]-2-cyclopropyl-propanoic acid Openeye Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]-2-cyclopropyl-propanoic acid CAS Name: 2-[[2-[(3-chlorophenyl)methylthio]-1-oxoethyl]amino]-2-cyclopropylpropanoic acid IUPAC Name: 2-[[2-[(3-chlorophenyl)methylsulfanyl]acetyl]amino]-2-cyclopropylpropanoic acid Traditional Name: 2-[[2-[(3-chlorobenzyl)thio]acetyl]amino]-2-cyclopropyl-propionic acid Formula: C15H18ClNO3S MolecularWeight: 327.82632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)(C(=O)O)NC(=O)CSCC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C1CC1)(C(=O)O)NC(=O)CSCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H18ClNO3S/c1-15(14(19)20,11-5-6-11)17-13(18)9-21-8-10-3-2-4-12(16)7-10/h2-4,7,11H,5-6,8-9H2,1H3,(H,17,18)(H,19,20)