N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]anthracene-9-carboxamide

Systemtic Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]anthracene-9-carboxamide Openeye Name: N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]anthracene-9-carboxamide CAS Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-9-anthracenecarboxamide IUPAC Name: N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]anthracene-9-carboxamide Traditional Name: N-[6-(diisobutylsulfamoyl)-1,3-benzothiazol-2-yl]anthracene-9-carboxamide Formula: C30H31N3O3S2 MolecularWeight: 545.71544

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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=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C30H31N3O3S2/c1-19(2)17-33(18-20(3)4)38(35,36)23-13-14-26-27(16-23)37-30(31-26)32-29(34)28-24-11-7-5-9-21(24)15-22-10-6-8-12-25(22)28/h5-16,19-20H,17-18H2,1-4H3,(H,31,32,34)