2-(4-chlorophenyl)-5-(1-methylpyrrol-2-yl)-N-(pyridin-4-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-5-(1-methylpyrrol-2-yl)-N-(pyridin-4-ylmethyl)pyrazole-3-carboxamide Openeye Name: 2-(4-chlorophenyl)-5-(1-methylpyrrol-2-yl)-N-(4-pyridylmethyl)pyrazole-3-carboxamide CAS Name: 2-(4-chlorophenyl)-5-(1-methyl-2-pyrrolyl)-N-(pyridin-4-ylmethyl)-3-pyrazolecarboxamide IUPAC Name: 2-(4-chlorophenyl)-5-(1-methylpyrrol-2-yl)-N-(pyridin-4-ylmethyl)pyrazole-3-carboxamide Traditional Name: 2-(4-chlorophenyl)-5-(1-methylpyrrol-2-yl)-N-(4-pyridylmethyl)pyrazole-3-carboxamide Formula: C21H18ClN5O MolecularWeight: 391.85352

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCC3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCC3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H18ClN5O/c1-26-12-2-3-19(26)18-13-20(21(28)24-14-15-8-10-23-11-9-15)27(25-18)17-6-4-16(22)5-7-17/h2-13H,14H2,1H3,(H,24,28)