2-isothiocyanato-5-methyl-1,3-di(propan-2-yl)benzene

Systemtic Name: 2-isothiocyanato-5-methyl-1,3-di(propan-2-yl)benzene Openeye Name: 1,3-diisopropyl-2-isothiocyanato-5-methyl-benzene CAS Name: 2-isothiocyanato-5-methyl-1,3-di(propan-2-yl)benzene IUPAC Name: 2-isothiocyanato-5-methyl-1,3-di(propan-2-yl)benzene Traditional Name: 1,3-diisopropyl-2-isothiocyanato-5-methyl-benzene Formula: C14H19NS MolecularWeight: 233.37236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NS/c1-9(2)12-6-11(5)7-13(10(3)4)14(12)15-8-16/h6-7,9-10H,1-5H3