6,7-dimethoxy-2-(4-methylsulfonylpiperazin-1-yl)quinazolin-4-amine hydrochloride

Systemtic Name: 6,7-dimethoxy-2-(4-methylsulfonylpiperazin-1-yl)quinazolin-4-amine hydrochloride Openeye Name: 6,7-dimethoxy-2-(4-methylsulfonylpiperazin-1-yl)quinazolin-4-amine hydrochloride CAS Name: 6,7-dimethoxy-2-(4-methylsulfonyl-1-piperazinyl)-4-quinazolinamine hydrochloride IUPAC Name: 6,7-dimethoxy-2-(4-methylsulfonylpiperazin-1-yl)quinazolin-4-amine hydrochloride Traditional Name: [2-(4-mesylpiperazino)-6,7-dimethoxy-quinazolin-4-yl]amine hydrochloride Formula: C15H22ClN5O4S MolecularWeight: 403.88428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)S(=O)(=O)C)N)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)S(=O)(=O)C)N)OC.Cl

InChI

InChI=1S/C15H21N5O4S.ClH/c1-23-12-8-10-11(9-13(12)24-2)17-15(18-14(10)16)19-4-6-20(7-5-19)25(3,21)22;/h8-9H,4-7H2,1-3H3,(H2,16,17,18);1H