[4-azanyl-6-(3,5,5-trimethyl-4H-pyrazol-1-yl)-1,3,5-triazin-2-yl]methyl carbamimidothioate

Systemtic Name: [4-azanyl-6-(3,5,5-trimethyl-4H-pyrazol-1-yl)-1,3,5-triazin-2-yl]methyl carbamimidothioate Openeye Name: 2-[[4-amino-6-(3,5,5-trimethyl-4H-pyrazol-1-yl)-1,3,5-triazin-2-yl]methyl]isothiourea CAS Name: carbamimidothioic acid [4-amino-6-(3,5,5-trimethyl-4H-pyrazol-1-yl)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(3,5,5-trimethyl-4H-pyrazol-1-yl)-1,3,5-triazin-2-yl]methyl carbamimidothioate Traditional Name: 2-[[4-amino-6-(3,5,5-trimethyl-2-pyrazolin-1-yl)-s-triazin-2-yl]methyl]isothiourea Formula: C11H18N8S MolecularWeight: 294.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C)C)C2=NC(=NC(=N2)CSC(=N)N)N

Isomeric SMILES

CC1=NN(C(C1)(C)C)C2=NC(=NC(=N2)CSC(=N)N)N

InChI

InChI=1S/C11H18N8S/c1-6-4-11(2,3)19(18-6)10-16-7(5-20-8(12)13)15-9(14)17-10/h4-5H2,1-3H3,(H3,12,13)(H2,14,15,16,17)