2-(5-oxidanylidene-3H-pyrazolo[1,5-c]quinazolin-2-yl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(5-oxidanylidene-3H-pyrazolo[1,5-c]quinazolin-2-yl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(5-oxo-3H-pyrazolo[1,5-c]quinazolin-2-yl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(5-oxo-3H-pyrazolo[1,5-c]quinazolin-2-yl)ethyl ester IUPAC Name: 2-(5-oxo-3H-pyrazolo[1,5-c]quinazolin-2-yl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(5-keto-3H-pyrazolo[1,5-c]quinazolin-2-yl)ethyl ester Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC3=C4C=CC=CC4=NC(=O)N3N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC3=C4C=CC=CC4=NC(=O)N3N2

InChI

InChI=1S/C19H17N3O4S/c1-13-6-8-15(9-7-13)27(24,25)26-11-10-14-12-18-16-4-2-3-5-17(16)20-19(23)22(18)21-14/h2-9,12,21H,10-11H2,1H3