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

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

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCN4C5=CC=CC=C5C(=O)C=N4

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCN4C5=CC=CC=C5C(=O)C=N4

InChI

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