S-[3-(2-methylpropyl)phenyl] N-[2,3-bis(bromanyl)propyl]carbamothioate

Systemtic Name: S-[3-(2-methylpropyl)phenyl] N-[2,3-bis(bromanyl)propyl]carbamothioate Openeye Name: S-(3-isobutylphenyl) N-(2,3-dibromopropyl)carbamothioate CAS Name: N-(2,3-dibromopropyl)carbamothioic acid S-[3-(2-methylpropyl)phenyl] ester IUPAC Name: S-[3-(2-methylpropyl)phenyl] N-(2,3-dibromopropyl)carbamothioate Traditional Name: N-(2,3-dibromopropyl)thiocarbamic acid S-(3-isobutylphenyl) ester Formula: C14H19Br2NOS MolecularWeight: 409.17976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=CC=C1)SC(=O)NCC(CBr)Br

Isomeric SMILES

CC(C)CC1=CC(=CC=C1)SC(=O)NCC(CBr)Br

InChI

InChI=1S/C14H19Br2NOS/c1-10(2)6-11-4-3-5-13(7-11)19-14(18)17-9-12(16)8-15/h3-5,7,10,12H,6,8-9H2,1-2H3,(H,17,18)