(E)-N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-3-(1,3-diphenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-3-(1,3-diphenylpyrazol-4-yl)acrylamide Formula: C28H25ClN4O3S MolecularWeight: 533.0411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25ClN4O3S/c29-25-15-14-24(37(35,36)32-17-7-8-18-32)19-26(25)30-27(34)16-13-22-20-33(23-11-5-2-6-12-23)31-28(22)21-9-3-1-4-10-21/h1-6,9-16,19-20H,7-8,17-18H2,(H,30,34)/b16-13+