(E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one CAS Name: (E)-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-1-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]-1-(4-pyrrolidinosulfonylphenyl)prop-2-en-1-one Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)/C=C/C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4O3S/c32-26(21-10-13-25(14-11-21)35(33,34)30-17-4-5-18-30)15-12-23-20-31(24-8-2-1-3-9-24)29-27(23)22-7-6-16-28-19-22/h1-3,6-16,19-20H,4-5,17-18H2/b15-12+