N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O5S/c1-19-10-11-20(34(31,32)28-14-16-33-17-15-28)18-22(19)24(29)26-23-9-5-4-8-21(23)25(30)27-12-6-2-3-7-13-27/h4-5,8-11,18H,2-3,6-7,12-17H2,1H3,(H,26,29)