4-tert-butyl-N-[2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[[4-(3-methoxypropyl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide Openeye Name: 4-tert-butyl-N-[2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzamide CAS Name: 4-tert-butyl-N-[2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[[4-(3-methoxypropyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[[5-keto-4-(3-methoxypropyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]benzamide Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NNC(=O)N2CCCOC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NNC(=O)N2CCCOC

InChI

InChI=1S/C19H26N4O4S/c1-19(2,3)14-8-6-13(7-9-14)16(25)20-15(24)12-28-18-22-21-17(26)23(18)10-5-11-27-4/h6-9H,5,10-12H2,1-4H3,(H,21,26)(H,20,24,25)