4-[4-[(E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]piperazin-1-yl]sulfonylbenzamide

Systemtic Name: 4-[4-[(E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]piperazin-1-yl]sulfonylbenzamide Openeye Name: 4-[4-[(E)-3-(1-benzylpyrazol-4-yl)prop-2-enoyl]piperazin-1-yl]sulfonylbenzamide CAS Name: 4-[[4-[(E)-1-oxo-3-[1-(phenylmethyl)-4-pyrazolyl]prop-2-enyl]-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 4-[4-[(E)-3-(1-benzylpyrazol-4-yl)prop-2-enoyl]piperazin-1-yl]sulfonylbenzamide Traditional Name: 4-[4-[(E)-3-(1-benzylpyrazol-4-yl)acryloyl]piperazino]sulfonylbenzamide Formula: C24H25N5O4S MolecularWeight: 479.5514

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C24H25N5O4S/c25-24(31)21-7-9-22(10-8-21)34(32,33)29-14-12-27(13-15-29)23(30)11-6-20-16-26-28(18-20)17-19-4-2-1-3-5-19/h1-11,16,18H,12-15,17H2,(H2,25,31)/b11-6+