2-methyl-5-[4-[[[(3S)-thiolan-3-yl]amino]methyl]piperidin-1-yl]pyridazin-3-one

Systemtic Name: 2-methyl-5-[4-[[[(3S)-thiolan-3-yl]amino]methyl]piperidin-1-yl]pyridazin-3-one Openeye Name: 2-methyl-5-[4-[[[(3S)-tetrahydrothiophen-3-yl]amino]methyl]-1-piperidyl]pyridazin-3-one CAS Name: 2-methyl-5-[4-[[[(3S)-3-thiolanyl]amino]methyl]-1-piperidinyl]-3-pyridazinone IUPAC Name: 2-methyl-5-[4-[[[(3S)-thiolan-3-yl]amino]methyl]piperidin-1-yl]pyridazin-3-one Traditional Name: 2-methyl-5-[4-[[[(3S)-tetrahydrothiophen-3-yl]amino]methyl]piperidino]pyridazin-3-one Formula: C15H24N4OS MolecularWeight: 308.44226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CCC(CC2)CNC3CCSC3

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CCC(CC2)CN[C@H]3CCSC3

InChI

InChI=1S/C15H24N4OS/c1-18-15(20)8-14(10-17-18)19-5-2-12(3-6-19)9-16-13-4-7-21-11-13/h8,10,12-13,16H,2-7,9,11H2,1H3/t13-/m0/s1