4-tert-butyl-N-[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[5-(2-methylallylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-tert-butyl-N-[5-(2-methylprop-2-enylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[5-(2-methylallylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C17H21N3OS2 MolecularWeight: 347.49814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(=C)CSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C17H21N3OS2/c1-11(2)10-22-16-20-19-15(23-16)18-14(21)12-6-8-13(9-7-12)17(3,4)5/h6-9H,1,10H2,2-5H3,(H,18,19,21)