N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide Openeye Name: N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide CAS Name: N-[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]-3-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-3-(2-phenoxyethoxy)benzamide Traditional Name: N-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoyl]-3-(2-phenoxyethoxy)benzamide Formula: C26H29N3O5S2 MolecularWeight: 527.65556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C26H29N3O5S2/c1-26(2,3)29-36(31,32)23-14-12-20(13-15-23)27-25(35)28-24(30)19-8-7-11-22(18-19)34-17-16-33-21-9-5-4-6-10-21/h4-15,18,29H,16-17H2,1-3H3,(H2,27,28,30,35)