N1,N4-bis[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]terephthalamide CAS Name: N1,N4-bis[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]terephthalamide Formula: C38H48N6O6S4 MolecularWeight: 813.08432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)N(CC(C)C)CC(C)C

Isomeric SMILES

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)N(CC(C)C)CC(C)C

InChI

InChI=1S/C38H48N6O6S4/c1-23(2)19-43(20-24(3)4)53(47,48)29-13-15-31-33(17-29)51-37(39-31)41-35(45)27-9-11-28(12-10-27)36(46)42-38-40-32-16-14-30(18-34(32)52-38)54(49,50)44(21-25(5)6)22-26(7)8/h9-18,23-26H,19-22H2,1-8H3,(H,39,41,45)(H,40,42,46)