2-[2-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1H-pyridazine-3,6-dione

Systemtic Name: 2-[2-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1H-pyridazine-3,6-dione Openeye Name: 2-[2-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-1H-pyridazine-3,6-dione CAS Name: 2-[2-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-oxoethyl]-1H-pyridazine-3,6-dione IUPAC Name: 2-[2-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione Traditional Name: 2-[2-[3-(1,3-benzothiazol-2-yl)piperidino]-2-keto-ethyl]-1H-pyridazine-3,6-quinone Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2C(=O)C=CC(=O)N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(CN(C1)C(=O)CN2C(=O)C=CC(=O)N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H18N4O3S/c23-15-7-8-16(24)22(20-15)11-17(25)21-9-3-4-12(10-21)18-19-13-5-1-2-6-14(13)26-18/h1-2,5-8,12H,3-4,9-11H2,(H,20,23)