2-[cyclopropylmethyl-(2-methyl-5-methylsulfanyl-phenyl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[cyclopropylmethyl-(2-methyl-5-methylsulfanyl-phenyl)carbonyl-amino]ethanoic acid Openeye Name: 2-[cyclopropylmethyl-(2-methyl-5-methylsulfanyl-benzoyl)amino]acetic acid CAS Name: 2-[cyclopropylmethyl-[[2-methyl-5-(methylthio)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[cyclopropylmethyl-(2-methyl-5-methylsulfanylbenzoyl)amino]acetic acid Traditional Name: 2-[cyclopropylmethyl-[2-methyl-5-(methylthio)benzoyl]amino]acetic acid Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)N(CC2CC2)CC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)N(CC2CC2)CC(=O)O

InChI

InChI=1S/C15H19NO3S/c1-10-3-6-12(20-2)7-13(10)15(19)16(9-14(17)18)8-11-4-5-11/h3,6-7,11H,4-5,8-9H2,1-2H3,(H,17,18)