6-(6-methoxypyridazin-3-yl)-2-(3-piperidin-1-ylpyrrolidin-1-yl)-1,3-benzothiazole

Systemtic Name: 6-(6-methoxypyridazin-3-yl)-2-(3-piperidin-1-ylpyrrolidin-1-yl)-1,3-benzothiazole Openeye Name: 6-(6-methoxypyridazin-3-yl)-2-[3-(1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazole CAS Name: 6-(6-methoxy-3-pyridazinyl)-2-[3-(1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazole IUPAC Name: 6-(6-methoxypyridazin-3-yl)-2-(3-piperidin-1-ylpyrrolidin-1-yl)-1,3-benzothiazole Traditional Name: 6-(6-methoxypyridazin-3-yl)-2-(3-piperidinopyrrolidino)-1,3-benzothiazole Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)C2=CC3=C(C=C2)N=C(S3)N4CCC(C4)N5CCCCC5

Isomeric SMILES

COC1=NN=C(C=C1)C2=CC3=C(C=C2)N=C(S3)N4CCC(C4)N5CCCCC5

InChI

InChI=1S/C21H25N5OS/c1-27-20-8-7-17(23-24-20)15-5-6-18-19(13-15)28-21(22-18)26-12-9-16(14-26)25-10-3-2-4-11-25/h5-8,13,16H,2-4,9-12,14H2,1H3