N-(4-fluorophenyl)-3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: N-(4-fluorophenyl)-3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,4-dimethylpentyl)-N-(4-fluorophenyl)-4-(4-nitrophenyl)thiazol-2-imine CAS Name: N-(4-fluorophenyl)-3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-2-thiazolimine IUPAC Name: N-(4-fluorophenyl)-3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [3-(1,4-dimethylpentyl)-4-(4-nitrophenyl)-4-thiazolin-2-ylidene]-(4-fluorophenyl)amine Formula: C22H24FN3O2S MolecularWeight: 413.508263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)N1C(=CSC1=NC2=CC=C(C=C2)F)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCC(C)N1C(=CSC1=NC2=CC=C(C=C2)F)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24FN3O2S/c1-15(2)4-5-16(3)25-21(17-6-12-20(13-7-17)26(27)28)14-29-22(25)24-19-10-8-18(23)9-11-19/h6-16H,4-5H2,1-3H3