5,6-bis(4-fluorophenyl)-3-(3-methylcyclohexyl)sulfanyl-1,2,4-triazine

Systemtic Name: 5,6-bis(4-fluorophenyl)-3-(3-methylcyclohexyl)sulfanyl-1,2,4-triazine Openeye Name: 5,6-bis(4-fluorophenyl)-3-(3-methylcyclohexyl)sulfanyl-1,2,4-triazine CAS Name: 5,6-bis(4-fluorophenyl)-3-[(3-methylcyclohexyl)thio]-1,2,4-triazine IUPAC Name: 5,6-bis(4-fluorophenyl)-3-(3-methylcyclohexyl)sulfanyl-1,2,4-triazine Traditional Name: 5,6-bis(4-fluorophenyl)-3-[(3-methylcyclohexyl)thio]-1,2,4-triazine Formula: C22H21F2N3S MolecularWeight: 397.484046

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)SC2=NC(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CC1CCCC(C1)SC2=NC(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21F2N3S/c1-14-3-2-4-19(13-14)28-22-25-20(15-5-9-17(23)10-6-15)21(26-27-22)16-7-11-18(24)12-8-16/h5-12,14,19H,2-4,13H2,1H3