4-(1,3-benzodioxol-5-yloxymethyl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[1-[(3-fluorophenyl)methyl]-4-pyrazolyl]-2-thiophenecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]thiophene-2-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[1-(3-fluorobenzyl)pyrazol-4-yl]thiophene-2-carboxamide Formula: C23H18FN3O4S MolecularWeight: 451.470123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC3=CSC(=C3)C(=O)NC4=CN(N=C4)CC5=CC(=CC=C5)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC3=CSC(=C3)C(=O)NC4=CN(N=C4)CC5=CC(=CC=C5)F

InChI

InChI=1S/C23H18FN3O4S/c24-17-3-1-2-15(6-17)10-27-11-18(9-25-27)26-23(28)22-7-16(13-32-22)12-29-19-4-5-20-21(8-19)31-14-30-20/h1-9,11,13H,10,12,14H2,(H,26,28)