2-[(3-azanyl-2-methyl-phenyl)methyl]-4-chloranyl-5-piperazin-1-yl-pyridazin-3-one

Systemtic Name: 2-[(3-azanyl-2-methyl-phenyl)methyl]-4-chloranyl-5-piperazin-1-yl-pyridazin-3-one Openeye Name: 2-[(3-amino-2-methyl-phenyl)methyl]-4-chloro-5-piperazin-1-yl-pyridazin-3-one CAS Name: 2-[(3-amino-2-methylphenyl)methyl]-4-chloro-5-(1-piperazinyl)-3-pyridazinone IUPAC Name: 2-[(3-amino-2-methylphenyl)methyl]-4-chloro-5-piperazin-1-ylpyridazin-3-one Traditional Name: 2-(3-amino-2-methyl-benzyl)-4-chloro-5-piperazino-pyridazin-3-one Formula: C16H20ClN5O MolecularWeight: 333.8159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)CN2C(=O)C(=C(C=N2)N3CCNCC3)Cl

Isomeric SMILES

CC1=C(C=CC=C1N)CN2C(=O)C(=C(C=N2)N3CCNCC3)Cl

InChI

InChI=1S/C16H20ClN5O/c1-11-12(3-2-4-13(11)18)10-22-16(23)15(17)14(9-20-22)21-7-5-19-6-8-21/h2-4,9,19H,5-8,10,18H2,1H3