2-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1H-quinoline-6-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-1H-quinoline-6-sulfonamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-oxo-1H-quinoline-6-sulfonamide CAS Name: 2-oxo-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-1H-quinoline-6-sulfonamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-oxo-1H-quinoline-6-sulfonamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-2-keto-1H-quinoline-6-sulfonamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O3S/c28-23-10-7-20-17-21(8-9-22(20)25-23)31(29,30)24-11-4-12-26-13-15-27(16-14-26)18-19-5-2-1-3-6-19/h1-3,5-10,17,24H,4,11-16,18H2,(H,25,28)