1-(2,4-dichlorophenyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: 1-(2,4-dichlorophenyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: 1-(2,4-dichlorophenyl)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: 1-(2,4-dichlorophenyl)-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propen-1-one IUPAC Name: 1-(2,4-dichlorophenyl)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-en-1-one Traditional Name: 1-(2,4-dichlorophenyl)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-en-1-one Formula: C22H14Cl2N2OS MolecularWeight: 425.33036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=CC(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=CC(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H14Cl2N2OS/c23-16-9-10-18(19(24)13-16)20(27)11-8-15-14-26(17-5-2-1-3-6-17)25-22(15)21-7-4-12-28-21/h1-14H