1-bromanyl-2-chloranyl-4-isothiocyanato-5-methyl-benzene

Systemtic Name: 1-bromanyl-2-chloranyl-4-isothiocyanato-5-methyl-benzene Openeye Name: 1-bromo-2-chloro-4-isothiocyanato-5-methyl-benzene CAS Name: 1-bromo-2-chloro-4-isothiocyanato-5-methylbenzene IUPAC Name: 1-bromo-2-chloro-4-isothiocyanato-5-methylbenzene Traditional Name: 1-bromo-2-chloro-4-isothiocyanato-5-methyl-benzene Formula: C8H5BrClNS MolecularWeight: 262.554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=C=S)Cl)Br

Isomeric SMILES

CC1=CC(=C(C=C1N=C=S)Cl)Br

InChI

InChI=1S/C8H5BrClNS/c1-5-2-6(9)7(10)3-8(5)11-4-12/h2-3H,1H3