2-[2-[[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]amino]ethylsulfanyl]ethanol

Systemtic Name: 2-[2-[[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]amino]ethylsulfanyl]ethanol Openeye Name: 2-[2-[[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]amino]ethylsulfanyl]ethanol CAS Name: 2-[2-[[2-[[2-[[2-(hydroxymethyl)phenyl]thio]phenyl]methylamino]-4-quinazolinyl]amino]ethylthio]ethanol IUPAC Name: 2-[2-[[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]amino]ethylsulfanyl]ethanol Traditional Name: 2-[2-[[2-[[2-[(2-methylolphenyl)thio]benzyl]amino]quinazolin-4-yl]amino]ethylthio]ethanol Formula: C26H28N4O2S2 MolecularWeight: 492.65612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC3=CC=CC=C3C(=N2)NCCSCCO)SC4=CC=CC=C4CO

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC3=CC=CC=C3C(=N2)NCCSCCO)SC4=CC=CC=C4CO

InChI

InChI=1S/C26H28N4O2S2/c31-14-16-33-15-13-27-25-21-9-3-4-10-22(21)29-26(30-25)28-17-19-7-1-5-11-23(19)34-24-12-6-2-8-20(24)18-32/h1-12,31-32H,13-18H2,(H2,27,28,29,30)