N-cyclohexyl-5-methyl-2-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzimidazole-1-carboxamide

Systemtic Name: N-cyclohexyl-5-methyl-2-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzimidazole-1-carboxamide Openeye Name: N-cyclohexyl-5-methyl-2-[(E)-(5-nitro-2-furyl)methyleneamino]benzimidazole-1-carboxamide CAS Name: N-cyclohexyl-5-methyl-2-[(E)-(5-nitro-2-furanyl)methylideneamino]-1-benzimidazolecarboxamide IUPAC Name: N-cyclohexyl-5-methyl-2-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzimidazole-1-carboxamide Traditional Name: N-cyclohexyl-5-methyl-2-[(E)-(5-nitro-2-furyl)methyleneamino]benzimidazole-1-carboxamide Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=N2)N=CC3=CC=C(O3)[N+](=O)[O-])C(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=N2)/N=C/C3=CC=C(O3)[N+](=O)[O-])C(=O)NC4CCCCC4

InChI

InChI=1S/C20H21N5O4/c1-13-7-9-17-16(11-13)23-19(21-12-15-8-10-18(29-15)25(27)28)24(17)20(26)22-14-5-3-2-4-6-14/h7-12,14H,2-6H2,1H3,(H,22,26)/b21-12+