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

Systemtic Name: 2-isothiocyanato-1,3-di(propan-2-yl)benzene Openeye Name: 1,3-diisopropyl-2-isothiocyanato-benzene CAS Name: 2-isothiocyanato-1,3-di(propan-2-yl)benzene IUPAC Name: 2-isothiocyanato-1,3-di(propan-2-yl)benzene Traditional Name: 1,3-diisopropyl-2-isothiocyanato-benzene Formula: C13H17NS MolecularWeight: 219.34578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NS/c1-9(2)11-6-5-7-12(10(3)4)13(11)14-8-15/h5-7,9-10H,1-4H3