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

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-(1-pyrrolyl)-3-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 4,5-dimethyl-2-pyrrol-1-ylthiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxylic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C15H16N6O2S MolecularWeight: 344.39154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=NC(=NC(=N2)N)N)N3C=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=NC(=NC(=N2)N)N)N3C=CC=C3)C

InChI

InChI=1S/C15H16N6O2S/c1-8-9(2)24-12(21-5-3-4-6-21)11(8)13(22)23-7-10-18-14(16)20-15(17)19-10/h3-6H,7H2,1-2H3,(H4,16,17,18,19,20)