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

Systemtic Name: S-(3-butylphenyl) N-(3-chloranylbutyl)carbamothioate Openeye Name: S-(3-butylphenyl) N-(3-chlorobutyl)carbamothioate CAS Name: N-(3-chlorobutyl)carbamothioic acid S-(3-butylphenyl) ester IUPAC Name: S-(3-butylphenyl) N-(3-chlorobutyl)carbamothioate Traditional Name: N-(3-chlorobutyl)thiocarbamic acid S-(3-butylphenyl) ester Formula: C15H22ClNOS MolecularWeight: 299.85928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)SC(=O)NCCC(C)Cl

Isomeric SMILES

CCCCC1=CC(=CC=C1)SC(=O)NCCC(C)Cl

InChI

InChI=1S/C15H22ClNOS/c1-3-4-6-13-7-5-8-14(11-13)19-15(18)17-10-9-12(2)16/h5,7-8,11-12H,3-4,6,9-10H2,1-2H3,(H,17,18)