N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C19H25N7O3 MolecularWeight: 399.4469

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N7O3/c1-3-23(4-2)11-12-25-17-8-6-5-7-16(17)21-19(25)22-18(27)9-10-24-14-15(13-20-24)26(28)29/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,21,22,27)