2-(3-bromanylphenoxy)ethyl 3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoate Openeye Name: 2-(3-bromophenoxy)ethyl 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-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 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-(3-bromophenoxy)ethyl ester Formula: C24H19BrN2O3S MolecularWeight: 495.38826

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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)OCCOC4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=CC(=O)OCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H19BrN2O3S/c25-19-6-4-9-21(16-19)29-13-14-30-23(28)12-11-18-17-27(20-7-2-1-3-8-20)26-24(18)22-10-5-15-31-22/h1-12,15-17H,13-14H2