2-[cyclopropylmethyl-[4-(methylsulfanylmethyl)phenyl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[cyclopropylmethyl-[4-(methylsulfanylmethyl)phenyl]carbonyl-amino]ethanoic acid Openeye Name: 2-[cyclopropylmethyl-[4-(methylsulfanylmethyl)benzoyl]amino]acetic acid CAS Name: 2-[cyclopropylmethyl-[[4-[(methylthio)methyl]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[cyclopropylmethyl-[4-(methylsulfanylmethyl)benzoyl]amino]acetic acid Traditional Name: 2-[cyclopropylmethyl-[4-[(methylthio)methyl]benzoyl]amino]acetic acid Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)N(CC2CC2)CC(=O)O

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)N(CC2CC2)CC(=O)O

InChI

InChI=1S/C15H19NO3S/c1-20-10-12-4-6-13(7-5-12)15(19)16(9-14(17)18)8-11-2-3-11/h4-7,11H,2-3,8-10H2,1H3,(H,17,18)