1-fluoranyl-2-isothiocyanato-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene

Systemtic Name: 1-fluoranyl-2-isothiocyanato-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene Openeye Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene CAS Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene IUPAC Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene Traditional Name: 1-fluoro-2-isothiocyanato-3-methyl-5-[4-(4-methylcyclohexyl)cyclohexyl]benzene Formula: C21H28FNS MolecularWeight: 345.517123

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C(=C3)F)N=C=S)C

Isomeric SMILES

CC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C(=C3)F)N=C=S)C

InChI

InChI=1S/C21H28FNS/c1-14-3-5-16(6-4-14)17-7-9-18(10-8-17)19-11-15(2)21(23-13-24)20(22)12-19/h11-12,14,16-18H,3-10H2,1-2H3