N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-2-propan-2-ylsulfanyl-benzamide

Systemtic Name: N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-2-propan-2-ylsulfanyl-benzamide Openeye Name: 2-isopropylsulfanyl-N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-2-(propan-2-ylthio)benzamide IUPAC Name: N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)-2-propan-2-ylsulfanylbenzamide Traditional Name: 2-(isopropylthio)-N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C17H23N3OS2 MolecularWeight: 349.51402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=NN=C(S1)NC(=O)C2=CC=CC=C2SC(C)C

Isomeric SMILES

CCCC(C)C1=NN=C(S1)NC(=O)C2=CC=CC=C2SC(C)C

InChI

InChI=1S/C17H23N3OS2/c1-5-8-12(4)16-19-20-17(23-16)18-15(21)13-9-6-7-10-14(13)22-11(2)3/h6-7,9-12H,5,8H2,1-4H3,(H,18,20,21)