7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-[2-(phenylsulfonyl)phenyl]quinolin-4-amine

Systemtic Name: 7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-N-[2-(phenylsulfonyl)phenyl]quinolin-4-amine Openeye Name: N-[2-(benzenesulfonyl)phenyl]-7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]quinolin-4-amine CAS Name: N-[2-(benzenesulfonyl)phenyl]-7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]-4-quinolinamine IUPAC Name: N-[2-(benzenesulfonyl)phenyl]-7-[3-[(2-methylsulfonylethylamino)methyl]phenyl]quinolin-4-amine Traditional Name: [3-[4-(2-besylanilino)-7-quinolyl]benzyl]-(2-mesylethyl)amine Formula: C31H29N3O4S2 MolecularWeight: 571.70966

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCNCC1=CC=CC(=C1)C2=CC3=NC=CC(=C3C=C2)NC4=CC=CC=C4S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)CCNCC1=CC=CC(=C1)C2=CC3=NC=CC(=C3C=C2)NC4=CC=CC=C4S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H29N3O4S2/c1-39(35,36)19-18-32-22-23-8-7-9-24(20-23)25-14-15-27-28(16-17-33-30(27)21-25)34-29-12-5-6-13-31(29)40(37,38)26-10-3-2-4-11-26/h2-17,20-21,32H,18-19,22H2,1H3,(H,33,34)