N-(5-pentyl-1,3,4-thiadiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C17H20N6OS2 MolecularWeight: 388.5103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

InChI

InChI=1S/C17H20N6OS2/c1-2-3-4-5-14-21-23-17(26-14)20-15(24)13-8-6-12(7-9-13)10-25-16-18-11-19-22-16/h6-9,11H,2-5,10H2,1H3,(H,18,19,22)(H,20,23,24)