2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-5-(5-ethyl-4-methyl-thiophen-2-yl)-1,3,4-oxadiazole

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-5-(5-ethyl-4-methyl-thiophen-2-yl)-1,3,4-oxadiazole Openeye Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanylmethyl]-5-(5-ethyl-4-methyl-2-thienyl)-1,3,4-oxadiazole CAS Name: 2-[[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]methyl]-5-(5-ethyl-4-methyl-2-thiophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-5-(5-ethyl-4-methylthiophen-2-yl)-1,3,4-oxadiazole Traditional Name: 2-[[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]methyl]-5-(5-ethyl-4-methyl-2-thienyl)-1,3,4-oxadiazole Formula: C21H26N4O3S3 MolecularWeight: 478.65114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C2=NN=C(O2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCCCC4)C

Isomeric SMILES

CCC1=C(C=C(S1)C2=NN=C(O2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCCCC4)C

InChI

InChI=1S/C21H26N4O3S3/c1-3-17-15(2)12-18(30-17)21-24-23-19(28-21)14-29-20-9-8-16(13-22-20)31(26,27)25-10-6-4-5-7-11-25/h8-9,12-13H,3-7,10-11,14H2,1-2H3