2-[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(3-pyridylmethyl)thiazole-5-carboxamide CAS Name: 2-[1-[(3-fluorophenyl)methyl]-3-pyrazolyl]-4-methyl-N-(3-pyridinylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-[1-[(3-fluorophenyl)methyl]pyrazol-3-yl]-4-methyl-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide Traditional Name: 2-[1-(3-fluorobenzyl)pyrazol-3-yl]-4-methyl-N-(3-pyridylmethyl)thiazole-5-carboxamide Formula: C21H18FN5OS MolecularWeight: 407.463923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=NN(C=C2)CC3=CC(=CC=C3)F)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)C2=NN(C=C2)CC3=CC(=CC=C3)F)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H18FN5OS/c1-14-19(20(28)24-12-16-5-3-8-23-11-16)29-21(25-14)18-7-9-27(26-18)13-15-4-2-6-17(22)10-15/h2-11H,12-13H2,1H3,(H,24,28)