N-(4-butylphenyl)-3-(5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide

Systemtic Name: N-(4-butylphenyl)-3-(5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide Openeye Name: N-(4-butylphenyl)-3-(5-oxo-3-thioxo-2H-1,2,4-triazin-6-yl)propanamide CAS Name: N-(4-butylphenyl)-3-(5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide IUPAC Name: N-(4-butylphenyl)-3-(5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide Traditional Name: N-(4-butylphenyl)-3-(5-keto-3-thioxo-2H-1,2,4-triazin-6-yl)propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCC2=NNC(=S)NC2=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCC2=NNC(=S)NC2=O

InChI

InChI=1S/C16H20N4O2S/c1-2-3-4-11-5-7-12(8-6-11)17-14(21)10-9-13-15(22)18-16(23)20-19-13/h5-8H,2-4,9-10H2,1H3,(H,17,21)(H2,18,20,22,23)