N-cyclohexyl-4-(furan-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine

Systemtic Name: N-cyclohexyl-4-(furan-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Openeye Name: N-cyclohexyl-4-(2-furyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: N-cyclohexyl-4-(2-furanyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-thiazolimine IUPAC Name: N-cyclohexyl-4-(furan-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Traditional Name: cyclohexyl-[4-(2-furyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]amine Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(C(=CS2)C3=CC=CO3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

C1CCC(CC1)N=C2N(C(=CS2)C3=CC=CO3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C21H20N4O5S/c26-25(27)16-10-20-19(29-13-30-20)9-14(16)11-22-24-17(18-7-4-8-28-18)12-31-21(24)23-15-5-2-1-3-6-15/h4,7-12,15H,1-3,5-6,13H2