4-tert-butyl-N-[3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]benzamide CAS Name: 4-tert-butyl-N-[1-oxo-3-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]thio]propyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]thio]propanoyl]benzamide Formula: C19H25N3O2S3 MolecularWeight: 423.6157

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)SCCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCSC1=NN=C(S1)SCCC(=O)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C19H25N3O2S3/c1-5-11-25-17-21-22-18(27-17)26-12-10-15(23)20-16(24)13-6-8-14(9-7-13)19(2,3)4/h6-9H,5,10-12H2,1-4H3,(H,20,23,24)