4-chloranyl-1,3-bis[3-(3-methylphenyl)propyl]benzimidazol-2-imine hydrochloride

Systemtic Name: 4-chloranyl-1,3-bis[3-(3-methylphenyl)propyl]benzimidazol-2-imine hydrochloride Openeye Name: 4-chloro-1,3-bis[3-(m-tolyl)propyl]benzimidazol-2-imine hydrochloride CAS Name: 4-chloro-1,3-bis[3-(3-methylphenyl)propyl]-2-benzimidazolimine hydrochloride IUPAC Name: 4-chloro-1,3-bis[3-(3-methylphenyl)propyl]benzimidazol-2-imine hydrochloride Traditional Name: [4-chloro-1,3-bis[3-(m-tolyl)propyl]benzimidazol-2-ylidene]amine hydrochloride Formula: C27H31Cl2N3 MolecularWeight: 468.46114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCCN2C3=C(C(=CC=C3)Cl)N(C2=N)CCCC4=CC=CC(=C4)C.Cl

Isomeric SMILES

CC1=CC(=CC=C1)CCCN2C3=C(C(=CC=C3)Cl)N(C2=N)CCCC4=CC=CC(=C4)C.Cl

InChI

InChI=1S/C27H30ClN3.ClH/c1-20-8-3-10-22(18-20)12-6-16-30-25-15-5-14-24(28)26(25)31(27(30)29)17-7-13-23-11-4-9-21(2)19-23;/h3-5,8-11,14-15,18-19,29H,6-7,12-13,16-17H2,1-2H3;1H