ethyl 2-(6-azanyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-(6-azanyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(6-amino-4-keto-4aH-quinazolin-3-ium-3-yl)-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C15H15N4O3S+ MolecularWeight: 331.3696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)[N+]2=CN=C3C=CC(=CC3C2=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)[N+]2=CN=C3C=CC(=CC3C2=O)N)C

InChI

InChI=1S/C15H15N4O3S/c1-3-22-14(21)12-8(2)18-15(23-12)19-7-17-11-5-4-9(16)6-10(11)13(19)20/h4-7,10H,3,16H2,1-2H3/q+1