N-(6-bromanyl-2-methyl-quinolin-4-yl)-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-bromanyl-2-methyl-quinolin-4-yl)-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-bromo-2-methyl-4-quinolyl)-4-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-bromo-2-methyl-4-quinolinyl)-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-bromo-2-methylquinolin-4-yl)-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-bromo-2-methyl-4-quinolyl)-4-piperidinosulfonyl-benzamide Formula: C22H22BrN3O3S MolecularWeight: 488.39738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=C1)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=C1)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H22BrN3O3S/c1-15-13-21(19-14-17(23)7-10-20(19)24-15)25-22(27)16-5-8-18(9-6-16)30(28,29)26-11-3-2-4-12-26/h5-10,13-14H,2-4,11-12H2,1H3,(H,24,25,27)