N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C24H21N3O3S/c28-24(25-14-18-8-9-20-21(13-18)30-11-10-29-20)19-16-27(15-17-5-2-1-3-6-17)26-23(19)22-7-4-12-31-22/h1-9,12-13,16H,10-11,14-15H2,(H,25,28)