N-butyl-2-methylsulfanyl-8-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-amine

Systemtic Name: N-butyl-2-methylsulfanyl-8-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-amine Openeye Name: N-butyl-2-methylsulfanyl-8-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-amine CAS Name: N-butyl-2-(methylthio)-8-phenyl-4-pyrazolo[1,5-a][1,3,5]triazinamine IUPAC Name: N-butyl-2-methylsulfanyl-8-phenylpyrazolo[1,5-a][1,3,5]triazin-4-amine Traditional Name: butyl-[2-(methylthio)-8-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl]amine Formula: C16H19N5S MolecularWeight: 313.42056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC2=C(C=NN21)C3=CC=CC=C3)SC

Isomeric SMILES

CCCCNC1=NC(=NC2=C(C=NN21)C3=CC=CC=C3)SC

InChI

InChI=1S/C16H19N5S/c1-3-4-10-17-15-20-16(22-2)19-14-13(11-18-21(14)15)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3,(H,17,19,20)