(E)-3-(1-phenylpyrazol-4-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-phenylpyrazol-4-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(1-phenylpyrazol-4-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(1-phenylpyrazol-4-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1-phenylpyrazol-4-yl)-1-[4-(2-thenoyl)piperazino]prop-2-en-1-one Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CN(N=C2)C3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H20N4O2S/c26-20(9-8-17-15-22-25(16-17)18-5-2-1-3-6-18)23-10-12-24(13-11-23)21(27)19-7-4-14-28-19/h1-9,14-16H,10-13H2/b9-8+