(2,4-dimethylphenyl)-isothiocyanato-methanone

Systemtic Name: (2,4-dimethylphenyl)-isothiocyanato-methanone Openeye Name: 2,4-dimethylbenzoyl isothiocyanate CAS Name: (2,4-dimethylphenyl)-isothiocyanatomethanone IUPAC Name: 2,4-dimethylbenzoyl isothiocyanate Traditional Name: (2,4-dimethylphenyl)-isothiocyanato-methanone Formula: C10H9NOS MolecularWeight: 191.24956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N=C=S)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N=C=S)C

InChI

InChI=1S/C10H9NOS/c1-7-3-4-9(8(2)5-7)10(12)11-6-13/h3-5H,1-2H3