N-(6-bromanyl-2-methyl-quinolin-4-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-bromanyl-2-methyl-quinolin-4-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-bromo-2-methyl-4-quinolyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(6-bromo-2-methyl-4-quinolinyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(6-bromo-2-methylquinolin-4-yl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(6-bromo-2-methyl-4-quinolyl)-3-pyrrolidinosulfonyl-benzamide Formula: C21H20BrN3O3S MolecularWeight: 474.3708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=C1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=C1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H20BrN3O3S/c1-14-11-20(18-13-16(22)7-8-19(18)23-14)24-21(26)15-5-4-6-17(12-15)29(27,28)25-9-2-3-10-25/h4-8,11-13H,2-3,9-10H2,1H3,(H,23,24,26)