3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]-2-piperidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]-2-piperidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[3-(3-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]-2-(piperidine-1-carbonyl)prop-2-enenitrile CAS Name: 3-[3-[3-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolyl]-2-[oxo(1-piperidinyl)methyl]-2-propenenitrile IUPAC Name: 3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]-2-(piperidine-1-carbonyl)prop-2-enenitrile Traditional Name: 3-[3-(3-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]-2-(piperidine-1-carbonyl)acrylonitrile Formula: C28H29N5O4S MolecularWeight: 531.62596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(=CC2=CN(N=C2C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CCN(CC1)C(=O)C(=CC2=CN(N=C2C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C28H29N5O4S/c29-20-23(28(34)31-12-5-2-6-13-31)18-24-21-33(25-9-3-1-4-10-25)30-27(24)22-8-7-11-26(19-22)38(35,36)32-14-16-37-17-15-32/h1,3-4,7-11,18-19,21H,2,5-6,12-17H2