ethyl (E)-3-azanyl-2-cyano-3-(5-oxidanylidene-2,7-diphenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-azanyl-2-cyano-3-(5-oxidanylidene-2,7-diphenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)prop-2-enoate Openeye Name: ethyl (E)-3-amino-2-cyano-3-(5-oxo-2,7-diphenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)prop-2-enoate CAS Name: (E)-3-amino-2-cyano-3-(5-oxo-2,7-diphenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-amino-2-cyano-3-(5-oxo-2,7-diphenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)prop-2-enoate Traditional Name: (E)-3-amino-2-cyano-3-(5-keto-2,7-diphenyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)acrylic acid ethyl ester Formula: C24H19N5O3 MolecularWeight: 425.43936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C1=C(N2C(=NC1=O)C=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)N)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\C1=C(N2C(=NC1=O)C=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)/N)/C#N

InChI

InChI=1S/C24H19N5O3/c1-2-32-24(31)17(14-25)21(26)20-22(16-11-7-4-8-12-16)29-19(27-23(20)30)13-18(28-29)15-9-5-3-6-10-15/h3-13,28H,2,26H2,1H3/b21-17+