2-[2-[(4-chlorophenyl)amino]-4-methyl-pentanoyl]-1,2-diazinane-1-carbonitrile

Systemtic Name: 2-[2-[(4-chlorophenyl)amino]-4-methyl-pentanoyl]-1,2-diazinane-1-carbonitrile Openeye Name: 2-[2-(4-chloroanilino)-4-methyl-pentanoyl]hexahydropyridazine-1-carbonitrile CAS Name: 2-[2-(4-chloroanilino)-4-methyl-1-oxopentyl]-1-diazinanecarbonitrile IUPAC Name: 2-[2-(4-chloroanilino)-4-methylpentanoyl]diazinane-1-carbonitrile Traditional Name: 2-[2-(4-chloroanilino)-4-methyl-pentanoyl]hexahydropyridazine-1-carbonitrile Formula: C17H23ClN4O MolecularWeight: 334.84372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCCN1C#N)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(C(=O)N1CCCCN1C#N)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H23ClN4O/c1-13(2)11-16(20-15-7-5-14(18)6-8-15)17(23)22-10-4-3-9-21(22)12-19/h5-8,13,16,20H,3-4,9-11H2,1-2H3