2-(4-bromophenyl)sulfanyl-5-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-5-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 2-(4-bromophenyl)sulfanyl-5-morpholinosulfonyl-N-(2-pyridylmethyl)benzamide CAS Name: 2-[(4-bromophenyl)thio]-5-(4-morpholinylsulfonyl)-N-(2-pyridinylmethyl)benzamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-5-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 2-[(4-bromophenyl)thio]-5-morpholinosulfonyl-N-(2-pyridylmethyl)benzamide Formula: C23H22BrN3O4S2 MolecularWeight: 548.47248

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Br)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)Br)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C23H22BrN3O4S2/c24-17-4-6-19(7-5-17)32-22-9-8-20(33(29,30)27-11-13-31-14-12-27)15-21(22)23(28)26-16-18-3-1-2-10-25-18/h1-10,15H,11-14,16H2,(H,26,28)