7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-(4-phenoxyphenyl)quinazolin-4-amine

Systemtic Name: 7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-(4-phenoxyphenyl)quinazolin-4-amine Openeye Name: 7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-(4-phenoxyphenyl)quinazolin-4-amine CAS Name: 7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-(4-phenoxyphenyl)-4-quinazolinamine IUPAC Name: 7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-(4-phenoxyphenyl)quinazolin-4-amine Traditional Name: 2-mesylethyl-[3-[4-(4-phenoxyanilino)quinazolin-7-yl]benzyl]amine Formula: C30H28N4O3S MolecularWeight: 524.63332

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNCC1=CC=CC(=C1)C2=CC3=C(C=C2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)CCNCC1=CC=CC(=C1)C2=CC3=C(C=C2)C(=NC=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C30H28N4O3S/c1-38(35,36)17-16-31-20-22-6-5-7-23(18-22)24-10-15-28-29(19-24)32-21-33-30(28)34-25-11-13-27(14-12-25)37-26-8-3-2-4-9-26/h2-15,18-19,21,31H,16-17,20H2,1H3,(H,32,33,34)