1,3-bis[2-(4-chlorophenyl)ethyl]-1,3-diazinane-5-carbonitrile

Systemtic Name: 1,3-bis[2-(4-chlorophenyl)ethyl]-1,3-diazinane-5-carbonitrile Openeye Name: 1,3-bis[2-(4-chlorophenyl)ethyl]hexahydropyrimidine-5-carbonitrile CAS Name: 1,3-bis[2-(4-chlorophenyl)ethyl]-1,3-diazinane-5-carbonitrile IUPAC Name: 1,3-bis[2-(4-chlorophenyl)ethyl]-1,3-diazinane-5-carbonitrile Traditional Name: 1,3-bis[2-(4-chlorophenyl)ethyl]hexahydropyrimidine-5-carbonitrile Formula: C21H23Cl2N3 MolecularWeight: 388.33342

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CN1CCC2=CC=C(C=C2)Cl)CCC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1C(CN(CN1CCC2=CC=C(C=C2)Cl)CCC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C21H23Cl2N3/c22-20-5-1-17(2-6-20)9-11-25-14-19(13-24)15-26(16-25)12-10-18-3-7-21(23)8-4-18/h1-8,19H,9-12,14-16H2