N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(3-fluoranyl-4-methoxy-phenyl)-N-methyl-methanamine

Systemtic Name: N-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]-1-(3-fluoranyl-4-methoxy-phenyl)-N-methyl-methanamine Openeye Name: N-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]-1-(3-fluoro-4-methoxy-phenyl)-N-methyl-methanamine CAS Name: N-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-1-(3-fluoro-4-methoxyphenyl)-N-methylmethanamine IUPAC Name: N-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]-1-(3-fluoro-4-methoxyphenyl)-N-methylmethanamine Traditional Name: (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl-(3-fluoro-4-methoxy-benzyl)-methyl-amine Formula: C24H31FN4O3S MolecularWeight: 474.591343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(C)CC4=CC(=C(C=C4)OC)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN(C)CC4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C24H31FN4O3S/c1-4-29-22-10-9-19(33(30,31)28-12-6-5-7-13-28)15-21(22)26-24(29)17-27(2)16-18-8-11-23(32-3)20(25)14-18/h8-11,14-15H,4-7,12-13,16-17H2,1-3H3