3-methyl-8-[4-(2-phenoxyethyl)piperazin-1-yl]sulfonyl-quinoline

Systemtic Name: 3-methyl-8-[4-(2-phenoxyethyl)piperazin-1-yl]sulfonyl-quinoline Openeye Name: 3-methyl-8-[4-(2-phenoxyethyl)piperazin-1-yl]sulfonyl-quinoline CAS Name: 3-methyl-8-[[4-(2-phenoxyethyl)-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 3-methyl-8-[4-(2-phenoxyethyl)piperazin-1-yl]sulfonylquinoline Traditional Name: 3-methyl-8-[4-(2-phenoxyethyl)piperazino]sulfonyl-quinoline Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O3S/c1-18-16-19-6-5-9-21(22(19)23-17-18)29(26,27)25-12-10-24(11-13-25)14-15-28-20-7-3-2-4-8-20/h2-9,16-17H,10-15H2,1H3