ethyl 8-cyano-6-methyl-2,3-diphenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylate

Systemtic Name: ethyl 8-cyano-6-methyl-2,3-diphenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylate Openeye Name: ethyl 8-cyano-6-methyl-2,3-diphenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylate CAS Name: 8-cyano-6-methyl-2,3-diphenyl-7-pyrrolo[1,2-b][1,2,4]triazinecarboxylic acid ethyl ester IUPAC Name: ethyl 8-cyano-6-methyl-2,3-diphenylpyrrolo[1,2-b][1,2,4]triazine-7-carboxylate Traditional Name: 8-cyano-6-methyl-2,3-diphenyl-pyrrolo[1,2-b][1,2,4]triazine-7-carboxylic acid ethyl ester Formula: C23H18N4O2 MolecularWeight: 382.41462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=C1C#N)N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N2C(=C1C#N)N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H18N4O2/c1-3-29-23(28)19-15(2)27-22(18(19)14-24)25-20(16-10-6-4-7-11-16)21(26-27)17-12-8-5-9-13-17/h4-13H,3H2,1-2H3