ethyl 2-(3-oxidanidyl-2-phenyl-quinazolin-3-ium-4-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(3-oxidanidyl-2-phenyl-quinazolin-3-ium-4-yl)sulfanylethanoate Openeye Name: ethyl 2-(3-oxido-2-phenyl-quinazolin-3-ium-4-yl)sulfanylacetate CAS Name: 2-[(3-oxido-2-phenyl-4-quinazolin-3-iumyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-oxido-2-phenylquinazolin-3-ium-4-yl)sulfanylacetate Traditional Name: 2-[(3-oxido-2-phenyl-quinazolin-3-ium-4-yl)thio]acetic acid ethyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=[N+](C(=NC2=CC=CC=C21)C3=CC=CC=C3)[O-]

Isomeric SMILES

CCOC(=O)CSC1=[N+](C(=NC2=CC=CC=C21)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C18H16N2O3S/c1-2-23-16(21)12-24-18-14-10-6-7-11-15(14)19-17(20(18)22)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3