3-methyl-1-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 3-methyl-1-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 3-methyl-N-(2-morpholinoethyl)-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 3-methyl-1-(4-methylphenyl)-N-[2-(4-morpholinyl)ethyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 3-methyl-1-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 3-methyl-N-(2-morpholinoethyl)-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)C(=O)NCCN3CCOCC3)N4C=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C(=O)NCCN3CCOCC3)N4C=CC=C4

InChI

InChI=1S/C22H27N5O2/c1-17-5-7-19(8-6-17)27-22(26-10-3-4-11-26)20(18(2)24-27)21(28)23-9-12-25-13-15-29-16-14-25/h3-8,10-11H,9,12-16H2,1-2H3,(H,23,28)