6-methoxy-3-(4-methoxyphenyl)sulfonyl-4-[4-(phenylmethyl)piperazin-1-yl]quinoline

Systemtic Name: 6-methoxy-3-(4-methoxyphenyl)sulfonyl-4-[4-(phenylmethyl)piperazin-1-yl]quinoline Openeye Name: 4-(4-benzylpiperazin-1-yl)-6-methoxy-3-(4-methoxyphenyl)sulfonyl-quinoline CAS Name: 6-methoxy-3-(4-methoxyphenyl)sulfonyl-4-[4-(phenylmethyl)-1-piperazinyl]quinoline IUPAC Name: 4-(4-benzylpiperazin-1-yl)-6-methoxy-3-(4-methoxyphenyl)sulfonylquinoline Traditional Name: 4-(4-benzylpiperazino)-6-methoxy-3-(4-methoxyphenyl)sulfonyl-quinoline Formula: C28H29N3O4S MolecularWeight: 503.61256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCN(CC4)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCN(CC4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C28H29N3O4S/c1-34-22-8-11-24(12-9-22)36(32,33)27-19-29-26-13-10-23(35-2)18-25(26)28(27)31-16-14-30(15-17-31)20-21-6-4-3-5-7-21/h3-13,18-19H,14-17,20H2,1-2H3