(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-1-piperidin-1-yl-prop-2-en-1-one

Systemtic Name: (E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-1-piperidin-1-yl-prop-2-en-1-one Openeye Name: (E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-1-(1-piperidyl)prop-2-en-1-one CAS Name: (E)-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-1-(1-piperidinyl)-2-propen-1-one IUPAC Name: (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)-1-piperidin-1-ylprop-2-en-1-one Traditional Name: (E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-1-piperidino-prop-2-en-1-one Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)/C=C/C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3OS/c25-20(23-13-5-2-6-14-23)12-11-17-16-24(18-8-3-1-4-9-18)22-21(17)19-10-7-15-26-19/h1,3-4,7-12,15-16H,2,5-6,13-14H2/b12-11+