2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-benzyl-2-[[5-keto-4-(3-methoxypropyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)NN=C1SCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

COCCCN1C(=O)NN=C1SCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C15H20N4O3S/c1-22-9-5-8-19-14(21)17-18-15(19)23-11-13(20)16-10-12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,16,20)(H,17,21)