N-[4-[[4-(1,3-benzothiazol-6-ylcarbonylamino)phenyl]methyl]phenyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[4-[[4-(1,3-benzothiazol-6-ylcarbonylamino)phenyl]methyl]phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[4-[[4-(1,3-benzothiazole-6-carbonylamino)phenyl]methyl]phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[4-[[4-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]phenyl]methyl]phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[4-[[4-(1,3-benzothiazole-6-carbonylamino)phenyl]methyl]phenyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[4-[4-(1,3-benzothiazole-6-carbonylamino)benzyl]phenyl]-1,3-benzothiazole-6-carboxamide Formula: C29H20N4O2S2 MolecularWeight: 520.6247

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)N=CS4)NC(=O)C5=CC6=C(C=C5)N=CS6

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)N=CS4)NC(=O)C5=CC6=C(C=C5)N=CS6

InChI

InChI=1S/C29H20N4O2S2/c34-28(20-5-11-24-26(14-20)36-16-30-24)32-22-7-1-18(2-8-22)13-19-3-9-23(10-4-19)33-29(35)21-6-12-25-27(15-21)37-17-31-25/h1-12,14-17H,13H2,(H,32,34)(H,33,35)