2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazole

Systemtic Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazole Openeye Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-1-ethyl-5-(1-piperidylsulfonyl)benzimidazole CAS Name: 2-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methyl]-1-ethyl-5-(1-piperidinylsulfonyl)benzimidazole IUPAC Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-1-ethyl-5-piperidin-1-ylsulfonylbenzimidazole Traditional Name: 2-[[4-(2,3-dimethylphenyl)piperazino]methyl]-1-ethyl-5-piperidinosulfonyl-benzimidazole Formula: C27H37N5O2S MolecularWeight: 495.67998

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCN(CC4)C5=CC=CC(=C5C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCN(CC4)C5=CC=CC(=C5C)C

InChI

InChI=1S/C27H37N5O2S/c1-4-32-26-12-11-23(35(33,34)31-13-6-5-7-14-31)19-24(26)28-27(32)20-29-15-17-30(18-16-29)25-10-8-9-21(2)22(25)3/h8-12,19H,4-7,13-18,20H2,1-3H3