1-[3-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]cinnolin-4-one

Systemtic Name: 1-[3-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]cinnolin-4-one Openeye Name: 1-[3-[2-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-oxo-propyl]cinnolin-4-one CAS Name: 1-[3-[2-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-oxopropyl]-4-cinnolinone IUPAC Name: 1-[3-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxopropyl]cinnolin-4-one Traditional Name: 1-[3-[2-(1,3-benzothiazol-2-yl)piperidino]-3-keto-propyl]cinnolin-4-one Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=O)CCN4C5=CC=CC=C5C(=O)C=N4

Isomeric SMILES

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=O)CCN4C5=CC=CC=C5C(=O)C=N4

InChI

InChI=1S/C23H22N4O2S/c28-20-15-24-27(18-9-3-1-7-16(18)20)14-12-22(29)26-13-6-5-10-19(26)23-25-17-8-2-4-11-21(17)30-23/h1-4,7-9,11,15,19H,5-6,10,12-14H2