2-[(2S)-4-(3-chloranylpyridin-2-yl)-2-methyl-piperazin-1-yl]-5,6-dimethyl-1H-benzimidazole

Systemtic Name: 2-[(2S)-4-(3-chloranylpyridin-2-yl)-2-methyl-piperazin-1-yl]-5,6-dimethyl-1H-benzimidazole Openeye Name: 2-[(2S)-4-(3-chloro-2-pyridyl)-2-methyl-piperazin-1-yl]-5,6-dimethyl-1H-benzimidazole CAS Name: 2-[(2S)-4-(3-chloro-2-pyridinyl)-2-methyl-1-piperazinyl]-5,6-dimethyl-1H-benzimidazole IUPAC Name: 2-[(2S)-4-(3-chloropyridin-2-yl)-2-methylpiperazin-1-yl]-5,6-dimethyl-1H-benzimidazole Traditional Name: 2-[(2S)-4-(3-chloro-2-pyridyl)-2-methyl-piperazino]-5,6-dimethyl-1H-benzimidazole Formula: C19H22ClN5 MolecularWeight: 355.86448

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC3=C(N2)C=C(C(=C3)C)C)C4=C(C=CC=N4)Cl

Isomeric SMILES

C[C@H]1CN(CCN1C2=NC3=C(N2)C=C(C(=C3)C)C)C4=C(C=CC=N4)Cl

InChI

InChI=1S/C19H22ClN5/c1-12-9-16-17(10-13(12)2)23-19(22-16)25-8-7-24(11-14(25)3)18-15(20)5-4-6-21-18/h4-6,9-10,14H,7-8,11H2,1-3H3,(H,22,23)/t14-/m0/s1