N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-(4-methyl-5-piperonyl-thiazol-2-yl)-1H-pyrazole-5-carboxamide Formula: C22H17FN4O3S MolecularWeight: 436.458783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17FN4O3S/c1-12-20(9-13-2-7-18-19(8-13)30-11-29-18)31-22(24-12)25-21(28)17-10-16(26-27-17)14-3-5-15(23)6-4-14/h2-8,10H,9,11H2,1H3,(H,26,27)(H,24,25,28)