N,N-dimethyl-4-[(E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]piperazine-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-[(E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]piperazine-1-sulfonamide Openeye Name: 4-[(E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)prop-2-enoyl]-N,N-dimethyl-piperazine-1-sulfonamide CAS Name: N,N-dimethyl-4-[(E)-1-oxo-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]prop-2-enyl]-1-piperazinesulfonamide IUPAC Name: 4-[(E)-3-(1-benzyl-3-phenylpyrazol-4-yl)prop-2-enoyl]-N,N-dimethylpiperazine-1-sulfonamide Traditional Name: 4-[(E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)acryloyl]-N,N-dimethyl-piperazine-1-sulfonamide Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C=CC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3S/c1-27(2)34(32,33)30-17-15-28(16-18-30)24(31)14-13-23-20-29(19-21-9-5-3-6-10-21)26-25(23)22-11-7-4-8-12-22/h3-14,20H,15-19H2,1-2H3/b14-13+