N-[(2S)-butan-2-yl]-3-[(3,4-dichlorophenyl)methylsulfanyl]propanamide

Systemtic Name: N-[(2S)-butan-2-yl]-3-[(3,4-dichlorophenyl)methylsulfanyl]propanamide Openeye Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-N-[(1S)-1-methylpropyl]propanamide CAS Name: N-[(2S)-butan-2-yl]-3-[(3,4-dichlorophenyl)methylthio]propanamide IUPAC Name: N-[(2S)-butan-2-yl]-3-[(3,4-dichlorophenyl)methylsulfanyl]propanamide Traditional Name: 3-[(3,4-dichlorobenzyl)thio]-N-[(1S)-1-methylpropyl]propionamide Formula: C14H19Cl2NOS MolecularWeight: 320.27776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CCSCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CC[C@H](C)NC(=O)CCSCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H19Cl2NOS/c1-3-10(2)17-14(18)6-7-19-9-11-4-5-12(15)13(16)8-11/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,17,18)/t10-/m0/s1