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

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-6-(3-chlorophenyl)-3-methyl-6,7-dihydro-5H-indazol-4-one Openeye Name: 1-(1,3-benzothiazol-2-yl)-6-(3-chlorophenyl)-3-methyl-6,7-dihydro-5H-indazol-4-one CAS Name: 1-(1,3-benzothiazol-2-yl)-6-(3-chlorophenyl)-3-methyl-6,7-dihydro-5H-indazol-4-one IUPAC Name: 1-(1,3-benzothiazol-2-yl)-6-(3-chlorophenyl)-3-methyl-6,7-dihydro-5H-indazol-4-one Traditional Name: 1-(1,3-benzothiazol-2-yl)-6-(3-chlorophenyl)-3-methyl-6,7-dihydro-5H-indazol-4-one Formula: C21H16ClN3OS MolecularWeight: 393.88924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=O)CC(C2)C3=CC(=CC=C3)Cl)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=NN(C2=C1C(=O)CC(C2)C3=CC(=CC=C3)Cl)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H16ClN3OS/c1-12-20-17(10-14(11-18(20)26)13-5-4-6-15(22)9-13)25(24-12)21-23-16-7-2-3-8-19(16)27-21/h2-9,14H,10-11H2,1H3