2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(2-methyl-4-oxo-quinazolin-3-yl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(2-methyl-4-oxo-3-quinazolinyl)ethyl ester IUPAC Name: 2-(2-methyl-4-oxoquinazolin-3-yl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(4-keto-2-methyl-quinazolin-3-yl)ethyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C(=NC3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C(=NC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C18H18N2O4S/c1-13-7-9-15(10-8-13)25(22,23)24-12-11-20-14(2)19-17-6-4-3-5-16(17)18(20)21/h3-10H,11-12H2,1-2H3