N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-4-morpholinosulfonyl-benzamide CAS Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridinyl]methyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[[6-(2,5-dimethylphenoxy)pyridin-3-yl]methyl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[[6-(2,5-dimethylphenoxy)-3-pyridyl]methyl]-4-morpholinosulfonyl-benzamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC=C(C=C2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H27N3O5S/c1-18-3-4-19(2)23(15-18)33-24-10-5-20(16-26-24)17-27-25(29)21-6-8-22(9-7-21)34(30,31)28-11-13-32-14-12-28/h3-10,15-16H,11-14,17H2,1-2H3,(H,27,29)