2-(1,3-benzodioxol-5-yl)-N-[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-[2-(6-methoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]acetamide Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CC2=CC3=C(C=C2)OCO3)C4=NC5=C(S4)C=C(C=C5)OC

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CC2=CC3=C(C=C2)OCO3)C4=NC5=C(S4)C=C(C=C5)OC

InChI

InChI=1S/C21H18N4O4S/c1-12-7-19(23-20(26)9-13-3-6-16-17(8-13)29-11-28-16)25(24-12)21-22-15-5-4-14(27-2)10-18(15)30-21/h3-8,10H,9,11H2,1-2H3,(H,23,26)