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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1,2-oxazole-5-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-isoxazole-5-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-3-phenyl-5-isoxazolecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1,2-oxazole-5-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-isoxazole-5-carboxamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O4S/c26-22(21-16-20(24-29-21)17-9-4-3-5-10-17)23-18-11-8-12-19(15-18)30(27,28)25-13-6-1-2-7-14-25/h3-5,8-12,15-16H,1-2,6-7,13-14H2,(H,23,26)