2-methyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]quinoline-8-sulfonamide

Systemtic Name: 2-methyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]-1-thiophen-2-yl-propan-2-yl]quinoline-8-sulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-(2-thienyl)ethyl]-2-methyl-quinoline-8-sulfonamide CAS Name: 2-methyl-N-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]-8-quinolinesulfonamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]-2-methylquinoline-8-sulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-2-(2-thienyl)ethyl]-2-methyl-quinoline-8-sulfonamide Formula: C28H32N4O2S2 MolecularWeight: 520.70928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2S(=O)(=O)NC(C)C(C3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2S(=O)(=O)NC(C)C(C3=CC=CS3)N4CCN(CC4)CC5=CC=CC=C5)C=C1

InChI

InChI=1S/C28H32N4O2S2/c1-21-13-14-24-10-6-12-26(27(24)29-21)36(33,34)30-22(2)28(25-11-7-19-35-25)32-17-15-31(16-18-32)20-23-8-4-3-5-9-23/h3-14,19,22,28,30H,15-18,20H2,1-2H3