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

Systemtic Name: 6,7-dimethoxy-2-[4-[4-(4-methylphenyl)phenyl]sulfonylpiperazin-1-yl]quinazolin-4-amine Openeye Name: 6,7-dimethoxy-2-[4-[4-(p-tolyl)phenyl]sulfonylpiperazin-1-yl]quinazolin-4-amine CAS Name: 6,7-dimethoxy-2-[4-[4-(4-methylphenyl)phenyl]sulfonyl-1-piperazinyl]-4-quinazolinamine IUPAC Name: 6,7-dimethoxy-2-[4-[4-(4-methylphenyl)phenyl]sulfonylpiperazin-1-yl]quinazolin-4-amine Traditional Name: [6,7-dimethoxy-2-[4-[4-(p-tolyl)phenyl]sulfonylpiperazino]quinazolin-4-yl]amine Formula: C27H29N5O4S MolecularWeight: 519.61526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC

InChI

InChI=1S/C27H29N5O4S/c1-18-4-6-19(7-5-18)20-8-10-21(11-9-20)37(33,34)32-14-12-31(13-15-32)27-29-23-17-25(36-3)24(35-2)16-22(23)26(28)30-27/h4-11,16-17H,12-15H2,1-3H3,(H2,28,29,30)