6-[4-(2-methylsulfonylethylamino)butoxy]-N-[4-(phenylsulfonyl)phenyl]quinazolin-4-amine

Systemtic Name: 6-[4-(2-methylsulfonylethylamino)butoxy]-N-[4-(phenylsulfonyl)phenyl]quinazolin-4-amine Openeye Name: N-[4-(benzenesulfonyl)phenyl]-6-[4-(2-methylsulfonylethylamino)butoxy]quinazolin-4-amine CAS Name: N-[4-(benzenesulfonyl)phenyl]-6-[4-(2-methylsulfonylethylamino)butoxy]-4-quinazolinamine IUPAC Name: N-[4-(benzenesulfonyl)phenyl]-6-[4-(2-methylsulfonylethylamino)butoxy]quinazolin-4-amine Traditional Name: 4-[4-(4-besylanilino)quinazolin-6-yl]oxybutyl-(2-mesylethyl)amine Formula: C27H30N4O5S2 MolecularWeight: 554.6809

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNCCCCOC1=CC2=C(C=C1)N=CN=C2NC3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)CCNCCCCOC1=CC2=C(C=C1)N=CN=C2NC3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H30N4O5S2/c1-37(32,33)18-16-28-15-5-6-17-36-22-11-14-26-25(19-22)27(30-20-29-26)31-21-9-12-24(13-10-21)38(34,35)23-7-3-2-4-8-23/h2-4,7-14,19-20,28H,5-6,15-18H2,1H3,(H,29,30,31)