S-(3-ethylphenyl) N-(3-chloranylbutyl)carbamothioate

Systemtic Name: S-(3-ethylphenyl) N-(3-chloranylbutyl)carbamothioate Openeye Name: S-(3-ethylphenyl) N-(3-chlorobutyl)carbamothioate CAS Name: N-(3-chlorobutyl)carbamothioic acid S-(3-ethylphenyl) ester IUPAC Name: S-(3-ethylphenyl) N-(3-chlorobutyl)carbamothioate Traditional Name: N-(3-chlorobutyl)thiocarbamic acid S-(3-ethylphenyl) ester Formula: C13H18ClNOS MolecularWeight: 271.80612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)SC(=O)NCCC(C)Cl

Isomeric SMILES

CCC1=CC(=CC=C1)SC(=O)NCCC(C)Cl

InChI

InChI=1S/C13H18ClNOS/c1-3-11-5-4-6-12(9-11)17-13(16)15-8-7-10(2)14/h4-6,9-10H,3,7-8H2,1-2H3,(H,15,16)