[2-(3-bromophenyl)-6-chloranyl-quinolin-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [2-(3-bromophenyl)-6-chloranyl-quinolin-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [2-(3-bromophenyl)-6-chloro-4-quinolyl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: [2-(3-bromophenyl)-6-chloro-4-quinolinyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [2-(3-bromophenyl)-6-chloroquinolin-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: [2-(3-bromophenyl)-6-chloro-4-quinolyl]-(4-mesylpiperazino)methanone Formula: C21H19BrClN3O3S MolecularWeight: 508.81586

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC(=CC=C4)Br

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H19BrClN3O3S/c1-30(28,29)26-9-7-25(8-10-26)21(27)18-13-20(14-3-2-4-15(22)11-14)24-19-6-5-16(23)12-17(18)19/h2-6,11-13H,7-10H2,1H3