2-[4-[4-(4-tert-butylphenyl)phenyl]sulfonylpiperazin-1-yl]-6,7-dimethoxy-quinazolin-4-amine hydrochloride

Systemtic Name: 2-[4-[4-(4-tert-butylphenyl)phenyl]sulfonylpiperazin-1-yl]-6,7-dimethoxy-quinazolin-4-amine hydrochloride Openeye Name: 2-[4-[4-(4-tert-butylphenyl)phenyl]sulfonylpiperazin-1-yl]-6,7-dimethoxy-quinazolin-4-amine hydrochloride CAS Name: 2-[4-[4-(4-tert-butylphenyl)phenyl]sulfonyl-1-piperazinyl]-6,7-dimethoxy-4-quinazolinamine hydrochloride IUPAC Name: 2-[4-[4-(4-tert-butylphenyl)phenyl]sulfonylpiperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine hydrochloride Traditional Name: [2-[4-[4-(4-tert-butylphenyl)phenyl]sulfonylpiperazino]-6,7-dimethoxy-quinazolin-4-yl]amine hydrochloride Formula: C30H36ClN5O4S MolecularWeight: 598.15594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC.Cl

InChI

InChI=1S/C30H35N5O4S.ClH/c1-30(2,3)22-10-6-20(7-11-22)21-8-12-23(13-9-21)40(36,37)35-16-14-34(15-17-35)29-32-25-19-27(39-5)26(38-4)18-24(25)28(31)33-29;/h6-13,18-19H,14-17H2,1-5H3,(H2,31,32,33);1H