2-[3-[5-(4-piperidin-1-ylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]phenyl]pyridazin-3-one

Systemtic Name: 2-[3-[5-(4-piperidin-1-ylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]phenyl]pyridazin-3-one Openeye Name: 2-[3-[5-[4-(1-piperidyl)-1-piperidyl]-1,3,4-thiadiazol-2-yl]phenyl]pyridazin-3-one CAS Name: 2-[3-[5-[4-(1-piperidinyl)-1-piperidinyl]-1,3,4-thiadiazol-2-yl]phenyl]-3-pyridazinone IUPAC Name: 2-[3-[5-(4-piperidin-1-ylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]phenyl]pyridazin-3-one Traditional Name: 2-[3-[5-(4-piperidinopiperidino)-1,3,4-thiadiazol-2-yl]phenyl]pyridazin-3-one Formula: C22H26N6OS MolecularWeight: 422.54644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C3=NN=C(S3)C4=CC(=CC=C4)N5C(=O)C=CC=N5

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C3=NN=C(S3)C4=CC(=CC=C4)N5C(=O)C=CC=N5

InChI

InChI=1S/C22H26N6OS/c29-20-8-5-11-23-28(20)19-7-4-6-17(16-19)21-24-25-22(30-21)27-14-9-18(10-15-27)26-12-2-1-3-13-26/h4-8,11,16,18H,1-3,9-10,12-15H2