(E)-1-(5-chloranylthiophen-2-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-chloranylthiophen-2-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(5-chloro-2-thienyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-(5-chloro-2-thiophenyl)-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(5-chlorothiophen-2-yl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(5-chloro-2-thienyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one Formula: C21H14ClN3OS MolecularWeight: 391.87336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=CC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)/C=C/C(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H14ClN3OS/c22-20-11-10-19(27-20)18(26)9-8-16-14-25(17-6-2-1-3-7-17)24-21(16)15-5-4-12-23-13-15/h1-14H/b9-8+