2-[(Z)-1-chloranyl-2-(5-methylthiophen-2-yl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid

Systemtic Name: 2-[(Z)-1-chloranyl-2-(5-methylthiophen-2-yl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid Openeye Name: 2-[(Z)-1-chloro-2-(5-methyl-2-thienyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylic acid CAS Name: 2-[(Z)-1-chloro-2-(5-methyl-2-thiophenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid IUPAC Name: 2-[(Z)-1-chloro-2-(5-methylthiophen-2-yl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid Traditional Name: 2-[(Z)-1-chloro-2-(5-methyl-2-thienyl)vinyl]-4-keto-1H-quinazoline-7-carboxylic acid Formula: C16H11ClN2O3S MolecularWeight: 346.78814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)Cl

Isomeric SMILES

CC1=CC=C(S1)/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)\Cl

InChI

InChI=1S/C16H11ClN2O3S/c1-8-2-4-10(23-8)7-12(17)14-18-13-6-9(16(21)22)3-5-11(13)15(20)19-14/h2-7H,1H3,(H,21,22)(H,18,19,20)/b12-7-