N6-ethyl-N6-[[4-(phenylsulfonyl)phenyl]methyl]quinazoline-2,4,6-triamine

Systemtic Name: N6-ethyl-N6-[[4-(phenylsulfonyl)phenyl]methyl]quinazoline-2,4,6-triamine Openeye Name: N6-[[4-(benzenesulfonyl)phenyl]methyl]-N6-ethyl-quinazoline-2,4,6-triamine CAS Name: N6-[[4-(benzenesulfonyl)phenyl]methyl]-N6-ethylquinazoline-2,4,6-triamine IUPAC Name: 6-N-[[4-(benzenesulfonyl)phenyl]methyl]-6-N-ethylquinazoline-2,4,6-triamine Traditional Name: (4-besylbenzyl)-(2,4-diaminoquinazolin-6-yl)-ethyl-amine Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2)C3=CC4=C(C=C3)N=C(N=C4N)N

Isomeric SMILES

CCN(CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2)C3=CC4=C(C=C3)N=C(N=C4N)N

InChI

InChI=1S/C23H23N5O2S/c1-2-28(17-10-13-21-20(14-17)22(24)27-23(25)26-21)15-16-8-11-19(12-9-16)31(29,30)18-6-4-3-5-7-18/h3-14H,2,15H2,1H3,(H4,24,25,26,27)