N-(3-fluoranyl-4-methyl-phenyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]propanamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]propanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]propionamide Formula: C24H27FN4O3S MolecularWeight: 470.559583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=CC(=CN=C43)C)F

InChI

InChI=1S/C24H27FN4O3S/c1-16-13-19-5-4-6-22(23(19)26-15-16)33(31,32)29-11-9-28(10-12-29)18(3)24(30)27-20-8-7-17(2)21(25)14-20/h4-8,13-15,18H,9-12H2,1-3H3,(H,27,30)