N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C24H33N4O3S+ MolecularWeight: 457.60882

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C)C

InChI

InChI=1S/C24H32N4O3S/c1-4-26-12-14-27(15-13-26)22-10-8-21(16-18(22)2)25-24(29)20-7-9-23-19(17-20)6-5-11-28(23)32(3,30)31/h7-10,16-17H,4-6,11-15H2,1-3H3,(H,25,29)/p+1