6-methyl-3-[(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]pyran-2,4-dione

Systemtic Name: 6-methyl-3-[(E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoyl]pyran-2,4-dione Openeye Name: 6-methyl-3-[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoyl]pyran-2,4-dione CAS Name: 6-methyl-3-[(E)-1-oxo-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)prop-2-enyl]pyran-2,4-dione IUPAC Name: 6-methyl-3-[(E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoyl]pyran-2,4-dione Traditional Name: 6-methyl-3-[(E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acryloyl]pyran-2,4-quinone Formula: C22H16N2O4S MolecularWeight: 404.43844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)C=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)/C=C/C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H16N2O4S/c1-14-12-18(26)20(22(27)28-14)17(25)10-9-15-13-24(16-6-3-2-4-7-16)23-21(15)19-8-5-11-29-19/h2-13,20H,1H3/b10-9+