ethyl 2-cyano-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: ethyl 2-cyano-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: ethyl 2-cyano-3-[3-(3-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: 2-cyano-3-[3-[3-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: 2-cyano-3-[3-(3-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]acrylic acid ethyl ester Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCOC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H24N4O5S/c1-2-34-25(30)20(17-26)15-21-18-29(22-8-4-3-5-9-22)27-24(21)19-7-6-10-23(16-19)35(31,32)28-11-13-33-14-12-28/h3-10,15-16,18H,2,11-14H2,1H3