N-(2-diethylaminoethyl)-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(2-diethylaminoethyl)-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(2-diethylaminoethyl)-1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(2-diethylaminoethyl)-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(2-diethylaminoethyl)-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C)N3C=CC=C3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C)N3C=CC=C3

InChI

InChI=1S/C21H27N5O/c1-4-24(5-2)15-12-22-20(27)19-16-23-26(18-10-8-17(3)9-11-18)21(19)25-13-6-7-14-25/h6-11,13-14,16H,4-5,12,15H2,1-3H3,(H,22,27)