4-azanyl-3-hexylsulfanyl-6-phenyl-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-hexylsulfanyl-6-phenyl-1,2,4-triazin-5-one Openeye Name: 4-amino-3-hexylsulfanyl-6-phenyl-1,2,4-triazin-5-one CAS Name: 4-amino-3-(hexylthio)-6-phenyl-1,2,4-triazin-5-one IUPAC Name: 4-amino-3-hexylsulfanyl-6-phenyl-1,2,4-triazin-5-one Traditional Name: 4-amino-3-(hexylthio)-6-phenyl-1,2,4-triazin-5-one Formula: C15H20N4OS MolecularWeight: 304.4105

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NN=C(C(=O)N1N)C2=CC=CC=C2

Isomeric SMILES

CCCCCCSC1=NN=C(C(=O)N1N)C2=CC=CC=C2

InChI

InChI=1S/C15H20N4OS/c1-2-3-4-8-11-21-15-18-17-13(14(20)19(15)16)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11,16H2,1H3