1-fluoranyl-2-isothiocyanato-3-methyl-5-[2-methyl-4-(4-methylphenyl)phenyl]benzene

Systemtic Name: 1-fluoranyl-2-isothiocyanato-3-methyl-5-[2-methyl-4-(4-methylphenyl)phenyl]benzene Openeye Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[2-methyl-4-(p-tolyl)phenyl]benzene CAS Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[2-methyl-4-(4-methylphenyl)phenyl]benzene IUPAC Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[2-methyl-4-(4-methylphenyl)phenyl]benzene Traditional Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[2-methyl-4-(p-tolyl)phenyl]benzene Formula: C22H18FNS MolecularWeight: 347.448423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)N=C=S)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)N=C=S)C)C

InChI

InChI=1S/C22H18FNS/c1-14-4-6-17(7-5-14)18-8-9-20(15(2)10-18)19-11-16(3)22(24-13-25)21(23)12-19/h4-12H,1-3H3