[5-[(4-fluorophenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenyl-methanone

Systemtic Name: [5-[(4-fluorophenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenyl-methanone Openeye Name: [5-[(4-fluorophenyl)methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-phenyl-methanone CAS Name: [5-[(4-fluorophenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-phenylmethanone IUPAC Name: [5-[(4-fluorophenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenylmethanone Traditional Name: [5-[(4-fluorobenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-phenyl-methanone Formula: C21H16FN5O MolecularWeight: 373.383043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN5O/c22-18-10-8-15(9-11-18)13-24-21-25-19(17-7-4-12-23-14-17)26-27(21)20(28)16-5-2-1-3-6-16/h1-12,14H,13H2,(H,24,25,26)