7-[5-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-2-yl]-N-(4-phenylmethoxyphenyl)quinolin-4-amine

Systemtic Name: 7-[5-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-2-yl]-N-(4-phenylmethoxyphenyl)quinolin-4-amine Openeye Name: N-(4-benzyloxyphenyl)-7-[5-[(2-methylsulfonylethylamino)methyl]thiazol-2-yl]quinolin-4-amine CAS Name: 7-[5-[(2-methylsulfonylethylamino)methyl]-2-thiazolyl]-N-(4-phenylmethoxyphenyl)-4-quinolinamine IUPAC Name: 7-[5-[(2-methylsulfonylethylamino)methyl]-1,3-thiazol-2-yl]-N-(4-phenylmethoxyphenyl)quinolin-4-amine Traditional Name: [2-[4-(4-benzoxyanilino)-7-quinolyl]thiazol-5-yl]methyl-(2-mesylethyl)amine Formula: C29H28N4O3S2 MolecularWeight: 544.68762

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNCC1=CN=C(S1)C2=CC3=NC=CC(=C3C=C2)NC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)CCNCC1=CN=C(S1)C2=CC3=NC=CC(=C3C=C2)NC4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O3S2/c1-38(34,35)16-15-30-18-25-19-32-29(37-25)22-7-12-26-27(13-14-31-28(26)17-22)33-23-8-10-24(11-9-23)36-20-21-5-3-2-4-6-21/h2-14,17,19,30H,15-16,18,20H2,1H3,(H,31,33)