(4-butoxyphenyl)-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-butoxyphenyl)-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-butoxyphenyl)-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]methanone CAS Name: (4-butoxyphenyl)-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: (4-butoxyphenyl)-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-butoxyphenyl)-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]methanone Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C

InChI

InChI=1S/C25H29N3O4S/c1-3-4-16-32-22-10-8-20(9-11-22)25(29)27-12-14-28(15-13-27)33(30,31)23-7-5-6-21-17-19(2)18-26-24(21)23/h5-11,17-18H,3-4,12-16H2,1-2H3