[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 5-ethyl-4-methyl-thiophene-2-carboxylate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 5-ethyl-4-methyl-thiophene-2-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 5-ethyl-4-methyl-thiophene-2-carboxylate CAS Name: 5-ethyl-4-methyl-2-thiophenecarboxylic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 5-ethyl-4-methylthiophene-2-carboxylate Traditional Name: 5-ethyl-4-methyl-thiophene-2-carboxylic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C12H15N5O2S MolecularWeight: 293.3448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)OCC2=NC(=NC(=N2)N)N)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)OCC2=NC(=NC(=N2)N)N)C

InChI

InChI=1S/C12H15N5O2S/c1-3-7-6(2)4-8(20-7)10(18)19-5-9-15-11(13)17-12(14)16-9/h4H,3,5H2,1-2H3,(H4,13,14,15,16,17)