4-[[5-chloranyl-2-(2-methylpropoxy)phenyl]methyl-ethyl-amino]pyridazine-3-carbonitrile

Systemtic Name: 4-[[5-chloranyl-2-(2-methylpropoxy)phenyl]methyl-ethyl-amino]pyridazine-3-carbonitrile Openeye Name: 4-[(5-chloro-2-isobutoxy-phenyl)methyl-ethyl-amino]pyridazine-3-carbonitrile CAS Name: 4-[[5-chloro-2-(2-methylpropoxy)phenyl]methyl-ethylamino]-3-pyridazinecarbonitrile IUPAC Name: 4-[[5-chloro-2-(2-methylpropoxy)phenyl]methyl-ethylamino]pyridazine-3-carbonitrile Traditional Name: 4-[(5-chloro-2-isobutoxy-benzyl)-ethyl-amino]pyridazine-3-carbonitrile Formula: C18H21ClN4O MolecularWeight: 344.83854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Cl)OCC(C)C)C2=C(N=NC=C2)C#N

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Cl)OCC(C)C)C2=C(N=NC=C2)C#N

InChI

InChI=1S/C18H21ClN4O/c1-4-23(17-7-8-21-22-16(17)10-20)11-14-9-15(19)5-6-18(14)24-12-13(2)3/h5-9,13H,4,11-12H2,1-3H3