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

Systemtic Name: 2-isothiocyanato-5-phenoxy-1,3-di(propan-2-yl)benzene Openeye Name: 1,3-diisopropyl-2-isothiocyanato-5-phenoxy-benzene CAS Name: 2-isothiocyanato-5-phenoxy-1,3-di(propan-2-yl)benzene IUPAC Name: 2-isothiocyanato-5-phenoxy-1,3-di(propan-2-yl)benzene Traditional Name: 1,3-diisopropyl-2-isothiocyanato-5-phenoxy-benzene Formula: C19H21NOS MolecularWeight: 311.44114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1N=C=S)C(C)C)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC(=CC(=C1N=C=S)C(C)C)OC2=CC=CC=C2

InChI

InChI=1S/C19H21NOS/c1-13(2)17-10-16(21-15-8-6-5-7-9-15)11-18(14(3)4)19(17)20-12-22/h5-11,13-14H,1-4H3