2-[4-(azepan-1-ylsulfonyl)phenyl]-5-methylsulfanyl-1,3,4-oxadiazole

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-methylsulfanyl-1,3,4-oxadiazole Openeye Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-methylsulfanyl-1,3,4-oxadiazole CAS Name: 2-[4-(1-azepanylsulfonyl)phenyl]-5-(methylthio)-1,3,4-oxadiazole IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-methylsulfanyl-1,3,4-oxadiazole Traditional Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-(methylthio)-1,3,4-oxadiazole Formula: C15H19N3O3S2 MolecularWeight: 353.45966

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CSC1=NN=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C15H19N3O3S2/c1-22-15-17-16-14(21-15)12-6-8-13(9-7-12)23(19,20)18-10-4-2-3-5-11-18/h6-9H,2-5,10-11H2,1H3