5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-1H-pyrazole-4-carboxamide Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-1H-pyrazole-4-carboxamide CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-1H-pyrazole-4-carboxamide IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-1H-pyrazole-4-carboxamide Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-1H-pyrazole-4-carboxamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(NN=C3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(NN=C3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H18N4O3S/c1-2-12-3-5-15-18(9-12)29-21(23-15)24-20(26)14-11-22-25-19(14)13-4-6-16-17(10-13)28-8-7-27-16/h3-6,9-11H,2,7-8H2,1H3,(H,22,25)(H,23,24,26)