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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)thio]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]acetamide Formula: C20H22N4O4S3 MolecularWeight: 478.60808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NN=C(O3)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSC3=NN=C(O3)C4=CC=CS4

InChI

InChI=1S/C20H22N4O4S3/c25-18(14-30-20-23-22-19(28-20)17-9-6-12-29-17)21-15-7-5-8-16(13-15)31(26,27)24-10-3-1-2-4-11-24/h5-9,12-13H,1-4,10-11,14H2,(H,21,25)