N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide Openeye Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide CAS Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-5-cyclopropyl-2-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-5-cyclopropyl-2-phenylpyrazole-3-carboxamide Traditional Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide Formula: C21H17ClN6O MolecularWeight: 404.85228

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4)C5=CC=CC=C5

InChI

InChI=1S/C21H17ClN6O/c22-15-8-9-19(27-13-23-12-24-27)18(10-15)25-21(29)20-11-17(14-6-7-14)26-28(20)16-4-2-1-3-5-16/h1-5,8-14H,6-7H2,(H,25,29)