(2-methylpiperidin-1-yl)-(3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-yl)methanone

Systemtic Name: (2-methylpiperidin-1-yl)-(3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-yl)methanone Openeye Name: (2-methyl-1-piperidyl)-[3-methyl-5-(1-piperidylsulfonyl)benzofuran-2-yl]methanone CAS Name: (2-methyl-1-piperidinyl)-[3-methyl-5-(1-piperidinylsulfonyl)-2-benzofuranyl]methanone IUPAC Name: (2-methylpiperidin-1-yl)-(3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-yl)methanone Traditional Name: (2-methylpiperidino)-(3-methyl-5-piperidinosulfonyl-benzofuran-2-yl)methanone Formula: C21H28N2O4S MolecularWeight: 404.52302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1CCCCN1C(=O)C2=C(C3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C21H28N2O4S/c1-15-8-4-7-13-23(15)21(24)20-16(2)18-14-17(9-10-19(18)27-20)28(25,26)22-11-5-3-6-12-22/h9-10,14-15H,3-8,11-13H2,1-2H3