N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-(o-tolyl)thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-(2-methylphenyl)-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 3-methyl-1-(o-tolyl)-N-piperonyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C22H19N3O3S MolecularWeight: 405.46956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C=C(S3)C(=O)NCC4=CC5=C(C=C4)OCO5)C(=N2)C

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=C(S3)C(=O)NCC4=CC5=C(C=C4)OCO5)C(=N2)C

InChI

InChI=1S/C22H19N3O3S/c1-13-5-3-4-6-17(13)25-22-16(14(2)24-25)10-20(29-22)21(26)23-11-15-7-8-18-19(9-15)28-12-27-18/h3-10H,11-12H2,1-2H3,(H,23,26)