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

Systemtic Name: S-(3-methoxyphenyl) N,N-bis[2,3-bis(bromanyl)propyl]carbamothioate Openeye Name: S-(3-methoxyphenyl) N,N-bis(2,3-dibromopropyl)carbamothioate CAS Name: N,N-bis(2,3-dibromopropyl)carbamothioic acid S-(3-methoxyphenyl) ester IUPAC Name: S-(3-methoxyphenyl) N,N-bis(2,3-dibromopropyl)carbamothioate Traditional Name: N,N-bis(2,3-dibromopropyl)thiocarbamic acid S-(3-methoxyphenyl) ester Formula: C14H17Br4NO2S MolecularWeight: 582.97128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC(=O)N(CC(CBr)Br)CC(CBr)Br

Isomeric SMILES

COC1=CC(=CC=C1)SC(=O)N(CC(CBr)Br)CC(CBr)Br

InChI

InChI=1S/C14H17Br4NO2S/c1-21-12-3-2-4-13(5-12)22-14(20)19(8-10(17)6-15)9-11(18)7-16/h2-5,10-11H,6-9H2,1H3