4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-(8-methylquinolin-5-yl)butanamide

Systemtic Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-(8-methylquinolin-5-yl)butanamide Openeye Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-(8-methyl-5-quinolyl)butanamide CAS Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-(8-methyl-5-quinolinyl)butanamide IUPAC Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-(8-methylquinolin-5-yl)butanamide Traditional Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-(8-methyl-5-quinolyl)butyramide Formula: C21H22FN3O3S MolecularWeight: 415.481083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F)C=CC=N2

InChI

InChI=1S/C21H22FN3O3S/c1-15-7-12-19(18-5-3-13-23-21(15)18)24-20(26)6-4-14-25(2)29(27,28)17-10-8-16(22)9-11-17/h3,5,7-13H,4,6,14H2,1-2H3,(H,24,26)