3-(2-ethylhexyl)-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(2-ethylhexyl)-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-1,3-thiazol-2-imine Openeye Name: 3-(2-ethylhexyl)-N-(2-isopropylphenyl)-4-(3-nitrophenyl)thiazol-2-imine CAS Name: 3-(2-ethylhexyl)-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-2-thiazolimine IUPAC Name: 3-(2-ethylhexyl)-4-(3-nitrophenyl)-N-(2-propan-2-ylphenyl)-1,3-thiazol-2-imine Traditional Name: [3-(2-ethylhexyl)-4-(3-nitrophenyl)-4-thiazolin-2-ylidene]-o-cumenyl-amine Formula: C26H33N3O2S MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1C(=CSC1=NC2=CC=CC=C2C(C)C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC(CC)CN1C(=CSC1=NC2=CC=CC=C2C(C)C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H33N3O2S/c1-5-7-11-20(6-2)17-28-25(21-12-10-13-22(16-21)29(30)31)18-32-26(28)27-24-15-9-8-14-23(24)19(3)4/h8-10,12-16,18-20H,5-7,11,17H2,1-4H3