N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-iodanyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-iodanyl-1H-pyrazole-5-carboxamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-iodo-1H-pyrazole-5-carboxamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-4-iodo-1H-pyrazole-5-carboxamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-iodo-1H-pyrazole-5-carboxamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-4-iodo-1H-pyrazole-5-carboxamide Formula: C17H21IN6O MolecularWeight: 452.29271

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=NN3)I

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=C(C=NN3)I

InChI

InChI=1S/C17H21IN6O/c1-3-23(4-2)9-10-24-14-8-6-5-7-13(14)20-17(24)21-16(25)15-12(18)11-19-22-15/h5-8,11H,3-4,9-10H2,1-2H3,(H,19,22)(H,20,21,25)