1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)propan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)propan-1-one Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H30N4O3S/c1-27-23-10-9-21(33(31,32)29-14-5-2-6-15-29)17-22(23)26-24(27)11-12-25(30)28-16-13-19-7-3-4-8-20(19)18-28/h3-4,7-10,17H,2,5-6,11-16,18H2,1H3