[2,6-bis(chloranyl)phenyl]methyl 3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: [2,6-bis(chloranyl)phenyl]methyl 3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoate Openeye Name: (2,6-dichlorophenyl)methyl 3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoate CAS Name: 3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propenoic acid (2,6-dichlorophenyl)methyl ester IUPAC Name: (2,6-dichlorophenyl)methyl 3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate Traditional Name: 3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylic acid (2,6-dichlorobenzyl) ester Formula: C23H16Cl2N2O2S MolecularWeight: 455.35634

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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)OCC4=C(C=CC=C4Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=CC(=O)OCC4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C23H16Cl2N2O2S/c24-19-8-4-9-20(25)18(19)15-29-22(28)12-11-16-14-27(17-6-2-1-3-7-17)26-23(16)21-10-5-13-30-21/h1-14H,15H2