N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C22H30N4O5S MolecularWeight: 462.5624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

InChI

InChI=1S/C22H30N4O5S/c1-16-21(17(2)31-24-16)22(27)23-19-15-18(32(28,29)26-11-13-30-14-12-26)7-8-20(19)25-9-5-3-4-6-10-25/h7-8,15H,3-6,9-14H2,1-2H3,(H,23,27)