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

Systemtic Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[5-(1-ethylpropyl)-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:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

InChI

InChI=1S/C17H20N6OS2/c1-3-12(4-2)15-21-23-17(26-15)20-14(24)13-7-5-11(6-8-13)9-25-16-18-10-19-22-16/h5-8,10,12H,3-4,9H2,1-2H3,(H,18,19,22)(H,20,23,24)