2-[(Z)-1-chloranyl-2-thiophen-3-yl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(Z)-1-chloranyl-2-thiophen-3-yl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-(3-thienyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(3-thiophenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-thiophen-3-ylethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(3-thienyl)vinyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C15H8ClN2O3S- MolecularWeight: 331.75362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])NC(=NC2=O)C(=CC3=CSC=C3)Cl

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])NC(=NC2=O)/C(=C/C3=CSC=C3)/Cl

InChI

InChI=1S/C15H9ClN2O3S/c16-11(5-8-3-4-22-7-8)13-17-12-6-9(15(20)21)1-2-10(12)14(19)18-13/h1-7H,(H,20,21)(H,17,18,19)/p-1/b11-5-