2-methyl-N-[3-[2-[4-(phenylmethyl)piperidin-1-yl]ethylsulfonyl]phenyl]quinolin-4-amine

Systemtic Name: 2-methyl-N-[3-[2-[4-(phenylmethyl)piperidin-1-yl]ethylsulfonyl]phenyl]quinolin-4-amine Openeye Name: N-[3-[2-(4-benzyl-1-piperidyl)ethylsulfonyl]phenyl]-2-methyl-quinolin-4-amine CAS Name: 2-methyl-N-[3-[2-[4-(phenylmethyl)-1-piperidinyl]ethylsulfonyl]phenyl]-4-quinolinamine IUPAC Name: N-[3-[2-(4-benzylpiperidin-1-yl)ethylsulfonyl]phenyl]-2-methylquinolin-4-amine Traditional Name: [3-[2-(4-benzylpiperidino)ethylsulfonyl]phenyl]-(2-methyl-4-quinolyl)amine Formula: C30H33N3O2S MolecularWeight: 499.66692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC3=CC(=CC=C3)S(=O)(=O)CCN4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC3=CC(=CC=C3)S(=O)(=O)CCN4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H33N3O2S/c1-23-20-30(28-12-5-6-13-29(28)31-23)32-26-10-7-11-27(22-26)36(34,35)19-18-33-16-14-25(15-17-33)21-24-8-3-2-4-9-24/h2-13,20,22,25H,14-19,21H2,1H3,(H,31,32)