N-[2-[5-oxidanylidene-3-(phenylmethylsulfanyl)-2H-1,2,4-triazin-6-yl]phenyl]propanamide

Systemtic Name: N-[2-[5-oxidanylidene-3-(phenylmethylsulfanyl)-2H-1,2,4-triazin-6-yl]phenyl]propanamide Openeye Name: N-[2-(3-benzylsulfanyl-5-oxo-2H-1,2,4-triazin-6-yl)phenyl]propanamide CAS Name: N-[2-[5-oxo-3-(phenylmethylthio)-2H-1,2,4-triazin-6-yl]phenyl]propanamide IUPAC Name: N-[2-(3-benzylsulfanyl-5-oxo-2H-1,2,4-triazin-6-yl)phenyl]propanamide Traditional Name: N-[2-[3-(benzylthio)-5-keto-2H-1,2,4-triazin-6-yl]phenyl]propionamide Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC=C1C2=NNC(=NC2=O)SCC3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC1=CC=CC=C1C2=NNC(=NC2=O)SCC3=CC=CC=C3

InChI

InChI=1S/C19H18N4O2S/c1-2-16(24)20-15-11-7-6-10-14(15)17-18(25)21-19(23-22-17)26-12-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,20,24)(H,21,23,25)