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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5-isopropyl-3-methyl-isoxazole-4-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-3-methyl-5-propan-2-yl-4-isoxazolecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5-isopropyl-3-methyl-isoxazole-4-carboxamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C(C)C

InChI

InChI=1S/C20H27N3O4S/c1-14(2)19-18(15(3)22-27-19)20(24)21-16-9-8-10-17(13-16)28(25,26)23-11-6-4-5-7-12-23/h8-10,13-14H,4-7,11-12H2,1-3H3,(H,21,24)