8-ethyl-2-methylsulfanyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-4-amine

Systemtic Name: 8-ethyl-2-methylsulfanyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-4-amine Openeye Name: 8-ethyl-2-methylsulfanyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-4-amine CAS Name: 8-ethyl-N-[(4-methylsulfonylphenyl)methyl]-2-(methylthio)-4-pyrazolo[1,5-a][1,3,5]triazinamine IUPAC Name: 8-ethyl-2-methylsulfanyl-N-[(4-methylsulfonylphenyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-4-amine Traditional Name: [8-ethyl-2-(methylthio)pyrazolo[1,5-a][1,3,5]triazin-4-yl]-(4-mesylbenzyl)amine Formula: C16H19N5O2S2 MolecularWeight: 377.48436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2N=C(N=C(N2N=C1)NCC3=CC=C(C=C3)S(=O)(=O)C)SC

Isomeric SMILES

CCC1=C2N=C(N=C(N2N=C1)NCC3=CC=C(C=C3)S(=O)(=O)C)SC

InChI

InChI=1S/C16H19N5O2S2/c1-4-12-10-18-21-14(12)19-16(24-2)20-15(21)17-9-11-5-7-13(8-6-11)25(3,22)23/h5-8,10H,4,9H2,1-3H3,(H,17,19,20)