N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]triazole-4-carboxamide CAS Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]triazole-4-carboxamide Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

InChI

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