S-(4-butylphenyl) N,N-bis(2-bromanyl-2-methyl-propyl)carbamothioate

Systemtic Name: S-(4-butylphenyl) N,N-bis(2-bromanyl-2-methyl-propyl)carbamothioate Openeye Name: S-(4-butylphenyl) N,N-bis(2-bromo-2-methyl-propyl)carbamothioate CAS Name: N,N-bis(2-bromo-2-methylpropyl)carbamothioic acid S-(4-butylphenyl) ester IUPAC Name: S-(4-butylphenyl) N,N-bis(2-bromo-2-methylpropyl)carbamothioate Traditional Name: N,N-bis(2-bromo-2-methyl-propyl)thiocarbamic acid S-(4-butylphenyl) ester Formula: C19H29Br2NOS MolecularWeight: 479.31266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)SC(=O)N(CC(C)(C)Br)CC(C)(C)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)SC(=O)N(CC(C)(C)Br)CC(C)(C)Br

InChI

InChI=1S/C19H29Br2NOS/c1-6-7-8-15-9-11-16(12-10-15)24-17(23)22(13-18(2,3)20)14-19(4,5)21/h9-12H,6-8,13-14H2,1-5H3