1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl (E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl (E)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl (E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propenoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl (E)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C26H20N4O3S MolecularWeight: 468.527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)/C=C/C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C26H20N4O3S/c1-17(25-27-21-11-6-5-10-20(21)26(32)28-25)33-23(31)14-13-18-16-30(19-8-3-2-4-9-19)29-24(18)22-12-7-15-34-22/h2-17H,1H3,(H,27,28,32)/b14-13+