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

Systemtic Name: 2-(4-bromophenyl)sulfanyl-N-butyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-(4-bromophenyl)sulfanyl-N-butyl-5-morpholinosulfonyl-benzamide CAS Name: 2-[(4-bromophenyl)thio]-N-butyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-N-butyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-[(4-bromophenyl)thio]-N-butyl-5-morpholinosulfonyl-benzamide Formula: C21H25BrN2O4S2 MolecularWeight: 513.4682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)SC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2O4S2/c1-2-3-10-23-21(25)19-15-18(30(26,27)24-11-13-28-14-12-24)8-9-20(19)29-17-6-4-16(22)5-7-17/h4-9,15H,2-3,10-14H2,1H3,(H,23,25)