8-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline

Systemtic Name: 8-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline Openeye Name: 8-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]sulfonyl-3-methyl-quinoline CAS Name: 8-[[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]sulfonyl]-3-methylquinoline IUPAC Name: 8-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]sulfonyl-3-methylquinoline Traditional Name: 8-[4-(2,5-dimethoxybenzyl)piperazino]sulfonyl-3-methyl-quinoline Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C23H27N3O4S/c1-17-13-18-5-4-6-22(23(18)24-15-17)31(27,28)26-11-9-25(10-12-26)16-19-14-20(29-2)7-8-21(19)30-3/h4-8,13-15H,9-12,16H2,1-3H3