2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-cyclopropyl-propanoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-cyclopropyl-propanoic acid Openeye Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-cyclopropyl-propanoic acid CAS Name: 2-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]-2-cyclopropylpropanoic acid IUPAC Name: 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-2-cyclopropylpropanoic acid Traditional Name: 2-[3-[(4-chlorophenyl)thio]propanoylamino]-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)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C1CC1)(C(=O)O)NC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClNO3S/c1-15(14(19)20,10-2-3-10)17-13(18)8-9-21-12-6-4-11(16)5-7-12/h4-7,10H,2-3,8-9H2,1H3,(H,17,18)(H,19,20)