1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzimidazole

Systemtic Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzimidazole Openeye Name: 1-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole CAS Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]benzimidazole IUPAC Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzimidazole Traditional Name: 1-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43

InChI

InChI=1S/C20H17N5O3/c1-13(2)14-7-9-15(10-8-14)28-20-18(25(26)27)19(21-11-22-20)24-12-23-16-5-3-4-6-17(16)24/h3-13H,1-2H3