N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-3-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C20H27N7O4 MolecularWeight: 429.47288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C=C(C(=N3)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C=C(C(=N3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H27N7O4/c1-4-24(5-2)12-13-26-16-9-7-6-8-15(16)21-20(26)22-18(28)10-11-25-14-17(27(29)30)19(23-25)31-3/h6-9,14H,4-5,10-13H2,1-3H3,(H,21,22,28)