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

Systemtic Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]thiophene-2-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)thiophene-2-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-2-thiophenecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(1-benzyl-3,5-dimethylpyrazol-4-yl)thiophene-2-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)thiophene-2-carboxamide Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)C3=CC(=CS3)COC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)NC(=O)C3=CC(=CS3)COC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H23N3O4S/c1-16-24(17(2)28(27-16)12-18-6-4-3-5-7-18)26-25(29)23-10-19(14-33-23)13-30-20-8-9-21-22(11-20)32-15-31-21/h3-11,14H,12-13,15H2,1-2H3,(H,26,29)