ethyl 4-azanyl-2-[[4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[4-amino-6-(2-ethylanilino)-s-triazin-2-yl]methylthio]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H22N8O2S MolecularWeight: 426.49538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=C(C(=N3)N)C(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=C(C(=N3)N)C(=O)OCC

InChI

InChI=1S/C19H22N8O2S/c1-3-11-7-5-6-8-13(11)23-18-25-14(24-17(21)27-18)10-30-19-22-9-12(15(20)26-19)16(28)29-4-2/h5-9H,3-4,10H2,1-2H3,(H2,20,22,26)(H3,21,23,24,25,27)