2-[ethyl-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl]amino]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[ethyl-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl]amino]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[ethyl-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl]amino]thiazole-5-carboxylic acid CAS Name: 2-[ethyl-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl]amino]-5-thiazolecarboxylic acid IUPAC Name: 2-[ethyl-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl]amino]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[ethyl-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl]amino]thiazole-5-carboxylic acid Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)NC(=NC2=O)C)C3=NC=C(S3)C(=O)O

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)NC(=NC2=O)C)C3=NC=C(S3)C(=O)O

InChI

InChI=1S/C16H16N4O3S/c1-3-20(16-17-7-13(24-16)15(22)23)8-10-4-5-12-11(6-10)14(21)19-9(2)18-12/h4-7H,3,8H2,1-2H3,(H,22,23)(H,18,19,21)