4-[2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile

Systemtic Name: 4-[2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methyl]-1-diazinanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]diazinan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile Formula: C21H22ClN5 MolecularWeight: 379.88588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2CCCCN2C3=CC=C(C4=CC=CC=C43)C#N)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CN2CCCCN2C3=CC=C(C4=CC=CC=C43)C#N)Cl)C

InChI

InChI=1S/C21H22ClN5/c1-15-19(21(22)25(2)24-15)14-26-11-5-6-12-27(26)20-10-9-16(13-23)17-7-3-4-8-18(17)20/h3-4,7-10H,5-6,11-12,14H2,1-2H3