N-(2-ethyl-6-methyl-phenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-morpholino-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-morpholino-5-piperidinosulfonyl-benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4)C

InChI

InChI=1S/C25H33N3O4S/c1-3-20-9-7-8-19(2)24(20)26-25(29)22-18-21(33(30,31)28-12-5-4-6-13-28)10-11-23(22)27-14-16-32-17-15-27/h7-11,18H,3-6,12-17H2,1-2H3,(H,26,29)