2-[2-[(3-methoxyphenyl)amino]-4-methyl-pentanoyl]-1,2-diazinane-1-carbonitrile

Systemtic Name: 2-[2-[(3-methoxyphenyl)amino]-4-methyl-pentanoyl]-1,2-diazinane-1-carbonitrile Openeye Name: 2-[2-(3-methoxyanilino)-4-methyl-pentanoyl]hexahydropyridazine-1-carbonitrile CAS Name: 2-[2-(3-methoxyanilino)-4-methyl-1-oxopentyl]-1-diazinanecarbonitrile IUPAC Name: 2-[2-(3-methoxyanilino)-4-methylpentanoyl]diazinane-1-carbonitrile Traditional Name: 2-[2-(m-anisidino)-4-methyl-pentanoyl]hexahydropyridazine-1-carbonitrile Formula: C18H26N4O2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O2/c1-14(2)11-17(20-15-7-6-8-16(12-15)24-3)18(23)22-10-5-4-9-21(22)13-19/h6-8,12,14,17,20H,4-5,9-11H2,1-3H3