8-methyl-N-[1-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide

Systemtic Name: 8-methyl-N-[1-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide Openeye Name: 8-methyl-N-[1-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide CAS Name: 8-methyl-N-[1-[4-(3-phenoxypropyl)-1-piperazinyl]ethyl]-5-quinolinesulfonamide IUPAC Name: 8-methyl-N-[1-[4-(3-phenoxypropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide Traditional Name: 8-methyl-N-[1-[4-(3-phenoxypropyl)piperazino]ethyl]quinoline-5-sulfonamide Formula: C25H32N4O3S MolecularWeight: 468.61158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)S(=O)(=O)NC(C)N3CCN(CC3)CCCOC4=CC=CC=C4)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)S(=O)(=O)NC(C)N3CCN(CC3)CCCOC4=CC=CC=C4)C=CC=N2

InChI

InChI=1S/C25H32N4O3S/c1-20-11-12-24(23-10-6-13-26-25(20)23)33(30,31)27-21(2)29-17-15-28(16-18-29)14-7-19-32-22-8-4-3-5-9-22/h3-6,8-13,21,27H,7,14-19H2,1-2H3