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

Systemtic Name: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]quinazolin-4-amine Openeye Name: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]quinazolin-4-amine CAS Name: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-4-quinazolinamine IUPAC Name: 6,7-dimethoxy-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]quinazolin-4-amine Traditional Name: [6,7-dimethoxy-2-[4-(4-methoxyphenyl)sulfonylpiperazino]quinazolin-4-yl]amine Formula: C21H25N5O5S MolecularWeight: 459.5187

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

InChI

InChI=1S/C21H25N5O5S/c1-29-14-4-6-15(7-5-14)32(27,28)26-10-8-25(9-11-26)21-23-17-13-19(31-3)18(30-2)12-16(17)20(22)24-21/h4-7,12-13H,8-11H2,1-3H3,(H2,22,23,24)