N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)OCCO3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)OCCO3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H16N4O3S/c1-12-10-18(24(23-12)20-21-14-4-2-3-5-17(14)28-20)22-19(25)13-6-7-15-16(11-13)27-9-8-26-15/h2-7,10-11H,8-9H2,1H3,(H,22,25)