O4-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl] ester O2-ethyl ester IUPAC Name: 4-O-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl] 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[(4-amino-6-anilino-s-triazin-2-yl)methyl] ester O2-ethyl ester Formula: C20H22N6O4 MolecularWeight: 410.42648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C

InChI

InChI=1S/C20H22N6O4/c1-4-29-18(28)16-11(2)15(12(3)22-16)17(27)30-10-14-24-19(21)26-20(25-14)23-13-8-6-5-7-9-13/h5-9,22H,4,10H2,1-3H3,(H3,21,23,24,25,26)