N-(2-methyl-3-sulfanyl-phenyl)pentanamide

Systemtic Name: N-(2-methyl-3-sulfanyl-phenyl)pentanamide Openeye Name: N-(2-methyl-3-sulfanyl-phenyl)pentanamide CAS Name: N-(3-mercapto-2-methylphenyl)pentanamide IUPAC Name: N-(2-methyl-3-sulfanylphenyl)pentanamide Traditional Name: N-(3-mercapto-2-methyl-phenyl)valeramide Formula: C12H17NOS MolecularWeight: 223.33448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CC=C1)S)C

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CC=C1)S)C

InChI

InChI=1S/C12H17NOS/c1-3-4-8-12(14)13-10-6-5-7-11(15)9(10)2/h5-7,15H,3-4,8H2,1-2H3,(H,13,14)