2-benzamido-4-propylsulfanyl-butanoic acid

Systemtic Name: 2-benzamido-4-propylsulfanyl-butanoic acid Openeye Name: 2-benzamido-4-propylsulfanyl-butanoic acid CAS Name: 2-benzamido-4-(propylthio)butanoic acid IUPAC Name: 2-benzamido-4-propylsulfanylbutanoic acid Traditional Name: 2-benzamido-4-(propylthio)butyric acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCC(C(=O)O)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCSCCC(C(=O)O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H19NO3S/c1-2-9-19-10-8-12(14(17)18)15-13(16)11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3,(H,15,16)(H,17,18)