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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butanamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]butyramide Formula: C23H28N4O4S2 MolecularWeight: 488.62282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCC2=NC(=NO2)C3=CC=CS3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCC2=NC(=NO2)C3=CC=CS3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H28N4O4S2/c1-17-11-12-18(16-20(17)33(29,30)27-13-4-2-3-5-14-27)24-21(28)9-6-10-22-25-23(26-31-22)19-8-7-15-32-19/h7-8,11-12,15-16H,2-6,9-10,13-14H2,1H3,(H,24,28)