1-[4-[3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]phenyl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]phenyl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]benzoyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[3-[6-(1,3-benzothiazol-6-ylamino)-3-pyridazinyl]phenyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]benzoyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[3-[6-(1,3-benzothiazol-6-ylamino)pyridazin-3-yl]benzoyl]piperazino]ethanone Formula: C24H22N6O2S MolecularWeight: 458.53548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC=CC(=C2)C3=NN=C(C=C3)NC4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC=CC(=C2)C3=NN=C(C=C3)NC4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C24H22N6O2S/c1-16(31)29-9-11-30(12-10-29)24(32)18-4-2-3-17(13-18)20-7-8-23(28-27-20)26-19-5-6-21-22(14-19)33-15-25-21/h2-8,13-15H,9-12H2,1H3,(H,26,28)