N-methyl-N-(quinolin-6-ylmethyl)-1-[4-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethoxy]phenyl]methanamine

Systemtic Name: N-methyl-N-(quinolin-6-ylmethyl)-1-[4-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethoxy]phenyl]methanamine Openeye Name: N-methyl-N-(6-quinolylmethyl)-1-[4-[2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethoxy]phenyl]methanamine CAS Name: N-methyl-N-(6-quinolinylmethyl)-1-[4-[2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethoxy]phenyl]methanamine IUPAC Name: N-methyl-N-(quinolin-6-ylmethyl)-1-[4-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethoxy]phenyl]methanamine Traditional Name: methyl-(6-quinolylmethyl)-[4-[2-[4-(2-thienylsulfonyl)piperazino]ethoxy]benzyl]amine Formula: C28H32N4O3S2 MolecularWeight: 536.70868

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCCN2CCN(CC2)S(=O)(=O)C3=CC=CS3)CC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCCN2CCN(CC2)S(=O)(=O)C3=CC=CS3)CC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C28H32N4O3S2/c1-30(22-24-8-11-27-25(20-24)4-2-12-29-27)21-23-6-9-26(10-7-23)35-18-17-31-13-15-32(16-14-31)37(33,34)28-5-3-19-36-28/h2-12,19-20H,13-18,21-22H2,1H3