2-methyl-5-[(3R)-3-[[(4-phenylcyclohexyl)amino]methyl]pyrrolidin-1-yl]pyridazin-3-one

Systemtic Name: 2-methyl-5-[(3R)-3-[[(4-phenylcyclohexyl)amino]methyl]pyrrolidin-1-yl]pyridazin-3-one Openeye Name: 2-methyl-5-[(3R)-3-[[(4-phenylcyclohexyl)amino]methyl]pyrrolidin-1-yl]pyridazin-3-one CAS Name: 2-methyl-5-[(3R)-3-[[(4-phenylcyclohexyl)amino]methyl]-1-pyrrolidinyl]-3-pyridazinone IUPAC Name: 2-methyl-5-[(3R)-3-[[(4-phenylcyclohexyl)amino]methyl]pyrrolidin-1-yl]pyridazin-3-one Traditional Name: 2-methyl-5-[(3R)-3-[[(4-phenylcyclohexyl)amino]methyl]pyrrolidino]pyridazin-3-one Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CCC(C2)CNC3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CC[C@@H](C2)CNC3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H30N4O/c1-25-22(27)13-21(15-24-25)26-12-11-17(16-26)14-23-20-9-7-19(8-10-20)18-5-3-2-4-6-18/h2-6,13,15,17,19-20,23H,7-12,14,16H2,1H3/t17-,19?,20?/m1/s1