1-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(3-morpholinopropyl)-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(4-methylphenyl)-N-[3-(4-morpholinyl)propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(3-morpholinopropyl)-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCCN3CCOCC3)N4C=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCCN3CCOCC3)N4C=CC=C4

InChI

InChI=1S/C22H27N5O2/c1-18-5-7-19(8-6-18)27-22(26-11-2-3-12-26)20(17-24-27)21(28)23-9-4-10-25-13-15-29-16-14-25/h2-3,5-8,11-12,17H,4,9-10,13-16H2,1H3,(H,23,28)