(E)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(2-thenoyl)piperazino]-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H22N4O2S/c1-13-15(14(2)20(3)19-13)6-7-17(23)21-8-10-22(11-9-21)18(24)16-5-4-12-25-16/h4-7,12H,8-11H2,1-3H3/b7-6+