[2-(4-bromophenyl)sulfanyl-5-morpholin-4-ylsulfonyl-phenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-(4-bromophenyl)sulfanyl-5-morpholin-4-ylsulfonyl-phenyl]-piperidin-1-yl-methanone Openeye Name: [2-(4-bromophenyl)sulfanyl-5-morpholinosulfonyl-phenyl]-(1-piperidyl)methanone CAS Name: [2-[(4-bromophenyl)thio]-5-(4-morpholinylsulfonyl)phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-(4-bromophenyl)sulfanyl-5-morpholin-4-ylsulfonylphenyl]-piperidin-1-ylmethanone Traditional Name: [2-[(4-bromophenyl)thio]-5-morpholinosulfonyl-phenyl]-piperidino-methanone Formula: C22H25BrN2O4S2 MolecularWeight: 525.4789

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)SC4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)SC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H25BrN2O4S2/c23-17-4-6-18(7-5-17)30-21-9-8-19(31(27,28)25-12-14-29-15-13-25)16-20(21)22(26)24-10-2-1-3-11-24/h4-9,16H,1-3,10-15H2