4-(1-benzofuran-2-yl)-3-(2,3-dimethylcyclohexyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: 4-(1-benzofuran-2-yl)-3-(2,3-dimethylcyclohexyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 4-(benzofuran-2-yl)-3-(2,3-dimethylcyclohexyl)-N-(2-nitrophenyl)thiazol-2-imine CAS Name: 4-(2-benzofuranyl)-3-(2,3-dimethylcyclohexyl)-N-(2-nitrophenyl)-2-thiazolimine IUPAC Name: 4-(1-benzofuran-2-yl)-3-(2,3-dimethylcyclohexyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [4-(benzofuran-2-yl)-3-(2,3-dimethylcyclohexyl)-4-thiazolin-2-ylidene]-(2-nitrophenyl)amine Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N2C(=CSC2=NC3=CC=CC=C3[N+](=O)[O-])C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1CCCC(C1C)N2C(=CSC2=NC3=CC=CC=C3[N+](=O)[O-])C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C25H25N3O3S/c1-16-8-7-12-20(17(16)2)27-22(24-14-18-9-3-6-13-23(18)31-24)15-32-25(27)26-19-10-4-5-11-21(19)28(29)30/h3-6,9-11,13-17,20H,7-8,12H2,1-2H3