ethyl 3-cyano-6-ethanoyl-7-[phenyl(phenylazanyl)methyl]-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate

Systemtic Name: ethyl 3-cyano-6-ethanoyl-7-[phenyl(phenylazanyl)methyl]-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate Openeye Name: ethyl 6-acetyl-7-[anilino(phenyl)methyl]-3-cyano-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate CAS Name: 6-acetyl-7-[anilino(phenyl)methyl]-3-cyano-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 6-acetyl-7-[anilino(phenyl)methyl]-3-cyano-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate Traditional Name: 6-acetyl-7-[anilino(phenyl)methyl]-3-cyano-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid ethyl ester Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=CN=C2N1NC=C2C#N)C(=O)C)C(C3=CC=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(C(=CN=C2N1NC=C2C#N)C(=O)C)C(C3=CC=CC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C25H23N5O3/c1-3-33-24(32)25(21(17(2)31)16-27-23-19(14-26)15-28-30(23)25)22(18-10-6-4-7-11-18)29-20-12-8-5-9-13-20/h4-13,15-16,22,28-29H,3H2,1-2H3