S-[4-(methylcarbamoyl)phenyl] pentanethioate

Systemtic Name: S-[4-(methylcarbamoyl)phenyl] pentanethioate Openeye Name: S-[4-(methylcarbamoyl)phenyl] pentanethioate CAS Name: pentanethioic acid S-[4-(methylcarbamoyl)phenyl] ester IUPAC Name: S-[4-(methylcarbamoyl)phenyl] pentanethioate Traditional Name: pentanethioic acid S-[4-(methylcarbamoyl)phenyl] ester Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)SC1=CC=C(C=C1)C(=O)NC

Isomeric SMILES

CCCCC(=O)SC1=CC=C(C=C1)C(=O)NC

InChI

InChI=1S/C13H17NO2S/c1-3-4-5-12(15)17-11-8-6-10(7-9-11)13(16)14-2/h6-9H,3-5H2,1-2H3,(H,14,16)