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

Systemtic Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C17H20N6OS/c1-3-13(4-2)16-21-22-17(25-16)20-15(24)14-7-5-12(6-8-14)9-23-11-18-10-19-23/h5-8,10-11,13H,3-4,9H2,1-2H3,(H,20,22,24)