3-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl]-5-(2-prop-2-enylsulfanylpyridin-3-yl)-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl]-5-(2-prop-2-enylsulfanylpyridin-3-yl)-1,3,4-oxadiazol-2-one Openeye Name: 5-(2-allylsulfanyl-3-pyridyl)-3-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]-1,3,4-oxadiazol-2-one CAS Name: 3-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]-5-[2-(prop-2-enylthio)-3-pyridinyl]-1,3,4-oxadiazol-2-one IUPAC Name: 3-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]-5-(2-prop-2-enylsulfanylpyridin-3-yl)-1,3,4-oxadiazol-2-one Traditional Name: 5-[2-(allylthio)-3-pyridyl]-3-[3-(2-keto-3H-benzimidazol-1-yl)propyl]-1,3,4-oxadiazol-2-one Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C=CC=N1)C2=NN(C(=O)O2)CCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C2=NN(C(=O)O2)CCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C20H19N5O3S/c1-2-13-29-18-14(7-5-10-21-18)17-23-25(20(27)28-17)12-6-11-24-16-9-4-3-8-15(16)22-19(24)26/h2-5,7-10H,1,6,11-13H2,(H,22,26)