4-morpholin-4-yl-2-propan-2-ylsulfanyl-quinazoline-7-carboxylic acid

Systemtic Name: 4-morpholin-4-yl-2-propan-2-ylsulfanyl-quinazoline-7-carboxylic acid Openeye Name: 2-isopropylsulfanyl-4-morpholino-quinazoline-7-carboxylic acid CAS Name: 4-(4-morpholinyl)-2-(propan-2-ylthio)-7-quinazolinecarboxylic acid IUPAC Name: 4-morpholin-4-yl-2-propan-2-ylsulfanylquinazoline-7-carboxylic acid Traditional Name: 2-(isopropylthio)-4-morpholino-quinazoline-7-carboxylic acid Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=C(C=CC(=C2)C(=O)O)C(=N1)N3CCOCC3

Isomeric SMILES

CC(C)SC1=NC2=C(C=CC(=C2)C(=O)O)C(=N1)N3CCOCC3

InChI

InChI=1S/C16H19N3O3S/c1-10(2)23-16-17-13-9-11(15(20)21)3-4-12(13)14(18-16)19-5-7-22-8-6-19/h3-4,9-10H,5-8H2,1-2H3,(H,20,21)