4-(1,3-benzodioxol-5-yloxymethyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]thiophene-2-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]thiophene-2-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]thiophene-2-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[3-(1-pyrazolylmethyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]thiophene-2-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]thiophene-2-carboxamide Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC3=CSC(=C3)C(=O)NC4=CC=CC(=C4)CN5C=CC=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC3=CSC(=C3)C(=O)NC4=CC=CC(=C4)CN5C=CC=N5

InChI

InChI=1S/C23H19N3O4S/c27-23(25-18-4-1-3-16(9-18)12-26-8-2-7-24-26)22-10-17(14-31-22)13-28-19-5-6-20-21(11-19)30-15-29-20/h1-11,14H,12-13,15H2,(H,25,27)