N,3-dicyclohexyl-4-(3-nitrophenyl)-1,3-thiazol-2-imine bromide

Systemtic Name: N,3-dicyclohexyl-4-(3-nitrophenyl)-1,3-thiazol-2-imine bromide Openeye Name: N,3-dicyclohexyl-4-(3-nitrophenyl)thiazol-2-imine bromide CAS Name: N,3-dicyclohexyl-4-(3-nitrophenyl)-2-thiazolimine bromide IUPAC Name: N,3-dicyclohexyl-4-(3-nitrophenyl)-1,3-thiazol-2-imine bromide Traditional Name: cyclohexyl-[3-cyclohexyl-4-(3-nitrophenyl)-4-thiazolin-2-ylidene]amine bromide Formula: C21H27BrN3O2S- MolecularWeight: 465.42698

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C4CCCCC4.[Br-]

Isomeric SMILES

C1CCC(CC1)N=C2N(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C4CCCCC4.[Br-]

InChI

InChI=1S/C21H27N3O2S.BrH/c25-24(26)19-13-7-8-16(14-19)20-15-27-21(22-17-9-3-1-4-10-17)23(20)18-11-5-2-6-12-18;/h7-8,13-15,17-18H,1-6,9-12H2;1H/p-1