3-(1,3-benzodioxol-5-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-1H-pyrazole-5-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(4-morpholinosulfonylphenyl)-1H-pyrazole-5-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(4-morpholinylsulfonyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(4-morpholin-4-ylsulfonylphenyl)-1H-pyrazole-5-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(4-morpholinosulfonylphenyl)-1H-pyrazole-5-carboxamide Formula: C21H20N4O6S MolecularWeight: 456.4717

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H20N4O6S/c26-21(18-12-17(23-24-18)14-1-6-19-20(11-14)31-13-30-19)22-15-2-4-16(5-3-15)32(27,28)25-7-9-29-10-8-25/h1-6,11-12H,7-10,13H2,(H,22,26)(H,23,24)