3-[4-oxidanylidene-2-[(E)-2-thiophen-3-ylethenyl]quinazolin-3-yl]propanoic acid

Systemtic Name: 3-[4-oxidanylidene-2-[(E)-2-thiophen-3-ylethenyl]quinazolin-3-yl]propanoic acid Openeye Name: 3-[4-oxo-2-[(E)-2-(3-thienyl)vinyl]quinazolin-3-yl]propanoic acid CAS Name: 3-[4-oxo-2-[(E)-2-(3-thiophenyl)ethenyl]-3-quinazolinyl]propanoic acid IUPAC Name: 3-[4-oxo-2-[(E)-2-thiophen-3-ylethenyl]quinazolin-3-yl]propanoic acid Traditional Name: 3-[4-keto-2-[(E)-2-(3-thienyl)vinyl]quinazolin-3-yl]propionic acid Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)C=CC3=CSC=C3)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)/C=C/C3=CSC=C3)CCC(=O)O

InChI

InChI=1S/C17H14N2O3S/c20-16(21)7-9-19-15(6-5-12-8-10-23-11-12)18-14-4-2-1-3-13(14)17(19)22/h1-6,8,10-11H,7,9H2,(H,20,21)/b6-5+