N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitropyrazol-1-yl)butanamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butyramide Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NCCC2=NC3=CC=CC=C3N2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NCCC2=NC3=CC=CC=C3N2)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N6O3/c1-12-18(24(26)27)13(2)23(22-12)11-5-8-17(25)19-10-9-16-20-14-6-3-4-7-15(14)21-16/h3-4,6-7H,5,8-11H2,1-2H3,(H,19,25)(H,20,21)