2-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl]-3,4-dihydro-1H-isoquinoline Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCC5=CC=CC=C5C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H30N4O2S/c1-2-28-23-11-10-21(31(29,30)27-13-6-3-7-14-27)16-22(23)25-24(28)18-26-15-12-19-8-4-5-9-20(19)17-26/h4-5,8-11,16H,2-3,6-7,12-15,17-18H2,1H3