N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C(=O)OC(=N3)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C(=O)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C20H22N4O5S2/c25-18(14-24-20(26)29-19(22-24)17-6-5-13-30-17)21-15-7-9-16(10-8-15)31(27,28)23-11-3-1-2-4-12-23/h5-10,13H,1-4,11-12,14H2,(H,21,25)