3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-1-(3-methylpiperidin-1-yl)propan-1-one

Systemtic Name: 3-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)-1-(3-methylpiperidin-1-yl)propan-1-one Openeye Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)-1-(3-methyl-1-piperidyl)propan-1-one CAS Name: 3-[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]-1-(3-methyl-1-piperidinyl)-1-propanone IUPAC Name: 3-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)-1-(3-methylpiperidin-1-yl)propan-1-one Traditional Name: 3-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)-1-(3-methylpiperidino)propan-1-one Formula: C22H32N4O4S MolecularWeight: 448.57888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)N4CCCC(C4)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCC(=O)N4CCCC(C4)C

InChI

InChI=1S/C22H32N4O4S/c1-3-26-20-7-6-18(31(28,29)25-11-13-30-14-12-25)15-19(20)23-21(26)8-9-22(27)24-10-4-5-17(2)16-24/h6-7,15,17H,3-5,8-14,16H2,1-2H3