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

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C19H25N3O5S MolecularWeight: 407.4839

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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)N3CCCCCC3)OC

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C19H25N3O5S/c1-13-18(14(2)27-21-13)19(23)20-16-12-15(8-9-17(16)26-3)28(24,25)22-10-6-4-5-7-11-22/h8-9,12H,4-7,10-11H2,1-3H3,(H,20,23)