2-[3-(4-chlorophenyl)sulfanylpropanoyl-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)sulfanylpropanoyl-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[3-(4-chlorophenyl)sulfanylpropanoyl-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[3-(4-chlorophenyl)sulfanylpropanoyl-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[3-[(4-chlorophenyl)thio]propanoyl-(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)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CC1CN(CC(=O)O)C(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClNO3S/c16-12-3-5-13(6-4-12)21-8-7-14(18)17(10-15(19)20)9-11-1-2-11/h3-6,11H,1-2,7-10H2,(H,19,20)