[2-[2-[[[4-(cyclopentylamino)quinazolin-2-yl]amino]methyl]phenyl]sulfanylphenyl]methanol

Systemtic Name: [2-[2-[[[4-(cyclopentylamino)quinazolin-2-yl]amino]methyl]phenyl]sulfanylphenyl]methanol Openeye Name: [2-[2-[[[4-(cyclopentylamino)quinazolin-2-yl]amino]methyl]phenyl]sulfanylphenyl]methanol CAS Name: [2-[[2-[[[4-(cyclopentylamino)-2-quinazolinyl]amino]methyl]phenyl]thio]phenyl]methanol IUPAC Name: [2-[2-[[[4-(cyclopentylamino)quinazolin-2-yl]amino]methyl]phenyl]sulfanylphenyl]methanol Traditional Name: [2-[[2-[[[4-(cyclopentylamino)quinazolin-2-yl]amino]methyl]phenyl]thio]phenyl]methanol Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC(=NC3=CC=CC=C32)NCC4=CC=CC=C4SC5=CC=CC=C5CO

Isomeric SMILES

C1CCC(C1)NC2=NC(=NC3=CC=CC=C32)NCC4=CC=CC=C4SC5=CC=CC=C5CO

InChI

InChI=1S/C27H28N4OS/c32-18-20-10-2-8-16-25(20)33-24-15-7-1-9-19(24)17-28-27-30-23-14-6-5-13-22(23)26(31-27)29-21-11-3-4-12-21/h1-2,5-10,13-16,21,32H,3-4,11-12,17-18H2,(H2,28,29,30,31)