1-(1,3-benzothiazol-2-yl)-6-(4-methoxyphenyl)-6,7-dihydro-5H-indazol-4-one

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-6-(4-methoxyphenyl)-6,7-dihydro-5H-indazol-4-one Openeye Name: 1-(1,3-benzothiazol-2-yl)-6-(4-methoxyphenyl)-6,7-dihydro-5H-indazol-4-one CAS Name: 1-(1,3-benzothiazol-2-yl)-6-(4-methoxyphenyl)-6,7-dihydro-5H-indazol-4-one IUPAC Name: 1-(1,3-benzothiazol-2-yl)-6-(4-methoxyphenyl)-6,7-dihydro-5H-indazol-4-one Traditional Name: 1-(1,3-benzothiazol-2-yl)-6-(4-methoxyphenyl)-6,7-dihydro-5H-indazol-4-one Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC3=C(C=NN3C4=NC5=CC=CC=C5S4)C(=O)C2

Isomeric SMILES

COC1=CC=C(C=C1)C2CC3=C(C=NN3C4=NC5=CC=CC=C5S4)C(=O)C2

InChI

InChI=1S/C21H17N3O2S/c1-26-15-8-6-13(7-9-15)14-10-18-16(19(25)11-14)12-22-24(18)21-23-17-4-2-3-5-20(17)27-21/h2-9,12,14H,10-11H2,1H3