2-(4-bromophenyl)sulfanyl-N-(3-methylbutyl)-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-N-(3-methylbutyl)-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-(4-bromophenyl)sulfanyl-N-isopentyl-5-morpholinosulfonyl-benzamide CAS Name: 2-[(4-bromophenyl)thio]-N-(3-methylbutyl)-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-N-(3-methylbutyl)-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-[(4-bromophenyl)thio]-N-isoamyl-5-morpholinosulfonyl-benzamide Formula: C22H27BrN2O4S2 MolecularWeight: 527.49478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27BrN2O4S2/c1-16(2)9-10-24-22(26)20-15-19(31(27,28)25-11-13-29-14-12-25)7-8-21(20)30-18-5-3-17(23)4-6-18/h3-8,15-16H,9-14H2,1-2H3,(H,24,26)