5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-benzyl-5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-benzyl-5-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-benzyl-5-[[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C18H20N6OS2 MolecularWeight: 400.521

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NN=C(S2)C(=O)NCC3=CC=CC=C3)C4CC4

Isomeric SMILES

CCN1C(=NN=C1SCC2=NN=C(S2)C(=O)NCC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C18H20N6OS2/c1-2-24-15(13-8-9-13)21-23-18(24)26-11-14-20-22-17(27-14)16(25)19-10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,19,25)