7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-[1-(phenylmethyl)indazol-5-yl]quinolin-4-amine

Systemtic Name: 7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-[1-(phenylmethyl)indazol-5-yl]quinolin-4-amine Openeye Name: N-(1-benzylindazol-5-yl)-7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]quinolin-4-amine CAS Name: 7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-[1-(phenylmethyl)-5-indazolyl]-4-quinolinamine IUPAC Name: N-(1-benzylindazol-5-yl)-7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]quinolin-4-amine Traditional Name: (1-benzylindazol-5-yl)-[7-[3-[(2-mesylethylamino)methyl]phenyl]-4-quinolyl]amine Formula: C33H31N5O2S MolecularWeight: 561.69654

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNCC1=CC=CC(=C1)C2=CC3=NC=CC(=C3C=C2)NC4=CC5=C(C=C4)N(N=C5)CC6=CC=CC=C6

Isomeric SMILES

CS(=O)(=O)CCNCC1=CC=CC(=C1)C2=CC3=NC=CC(=C3C=C2)NC4=CC5=C(C=C4)N(N=C5)CC6=CC=CC=C6

InChI

InChI=1S/C33H31N5O2S/c1-41(39,40)17-16-34-21-25-8-5-9-26(18-25)27-10-12-30-31(14-15-35-32(30)20-27)37-29-11-13-33-28(19-29)22-36-38(33)23-24-6-3-2-4-7-24/h2-15,18-20,22,34H,16-17,21,23H2,1H3,(H,35,37)