ethyl 6-azanyl-5-cyano-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=C(N(N=C2C)C3=CC=CC=C3)C)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=C(N(N=C2C)C3=CC=CC=C3)C)C#N)N)C

InChI

InChI=1S/C21H22N4O3/c1-5-27-21(26)18-14(4)28-20(23)16(11-22)19(18)17-12(2)24-25(13(17)3)15-9-7-6-8-10-15/h6-10,19H,5,23H2,1-4H3