ethyl 5-methyl-3-[3-(2-phenylimidazol-1-yl)propyl]-1,2,4-triazine-6-carboxylate

Systemtic Name: ethyl 5-methyl-3-[3-(2-phenylimidazol-1-yl)propyl]-1,2,4-triazine-6-carboxylate Openeye Name: ethyl 5-methyl-3-[3-(2-phenylimidazol-1-yl)propyl]-1,2,4-triazine-6-carboxylate CAS Name: 5-methyl-3-[3-(2-phenyl-1-imidazolyl)propyl]-1,2,4-triazine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-[3-(2-phenylimidazol-1-yl)propyl]-1,2,4-triazine-6-carboxylate Traditional Name: 5-methyl-3-[3-(2-phenylimidazol-1-yl)propyl]-1,2,4-triazine-6-carboxylic acid ethyl ester Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=N1)CCCN2C=CN=C2C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=N1)CCCN2C=CN=C2C3=CC=CC=C3)C

InChI

InChI=1S/C19H21N5O2/c1-3-26-19(25)17-14(2)21-16(22-23-17)10-7-12-24-13-11-20-18(24)15-8-5-4-6-9-15/h4-6,8-9,11,13H,3,7,10,12H2,1-2H3