4-tert-butyl-N-[3-[(2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]propanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[(2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]propanoyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[(2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]propanoyl]benzamide CAS Name: 4-tert-butyl-N-[1-oxo-3-[[2-(2-pyrrolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]propyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[(2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]propanoyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[(2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl)thio]propanoyl]benzamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CCSC2=NNC(=C3C=CC=N3)O2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CCSC2=NNC(=C3C=CC=N3)O2

InChI

InChI=1S/C20H22N4O3S/c1-20(2,3)14-8-6-13(7-9-14)17(26)22-16(25)10-12-28-19-24-23-18(27-19)15-5-4-11-21-15/h4-9,11,23H,10,12H2,1-3H3,(H,22,25,26)