1-[2-(2-chloroethylamino)benzimidazol-1-yl]-3,3-dimethyl-butan-2-one hydrochloride

Systemtic Name: 1-[2-(2-chloroethylamino)benzimidazol-1-yl]-3,3-dimethyl-butan-2-one hydrochloride Openeye Name: 1-[2-(2-chloroethylamino)benzimidazol-1-yl]-3,3-dimethyl-butan-2-one hydrochloride CAS Name: 1-[2-(2-chloroethylamino)-1-benzimidazolyl]-3,3-dimethyl-2-butanone hydrochloride IUPAC Name: 1-[2-(2-chloroethylamino)benzimidazol-1-yl]-3,3-dimethylbutan-2-one hydrochloride Traditional Name: 1-[2-(2-chloroethylamino)benzimidazol-1-yl]-3,3-dimethyl-butan-2-one hydrochloride Formula: C15H21Cl2N3O MolecularWeight: 330.25274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=C1NCCCl.Cl

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=C1NCCCl.Cl

InChI

InChI=1S/C15H20ClN3O.ClH/c1-15(2,3)13(20)10-19-12-7-5-4-6-11(12)18-14(19)17-9-8-16;/h4-7H,8-10H2,1-3H3,(H,17,18);1H