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

Systemtic Name: N-cyclohexyl-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Openeye Name: N-cyclohexyl-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: N-cyclohexyl-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-thiazolimine IUPAC Name: N-cyclohexyl-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Traditional Name: cyclohexyl-[4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]amine Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=NC2CCCCC2)N1N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CC1=CSC(=NC2CCCCC2)N1N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C18H20N4O4S/c1-12-10-27-18(20-14-5-3-2-4-6-14)21(12)19-9-13-7-16-17(26-11-25-16)8-15(13)22(23)24/h7-10,14H,2-6,11H2,1H3