N-(1,3-benzothiazol-2-yl)-2-phenyl-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-phenyl-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,3-benzothiazol-2-yl)-2-phenyl-acetamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(1,3-benzothiazol-2-yl)-2-phenylacetamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,3-benzothiazol-2-yl)-2-phenylacetamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(1,3-benzothiazol-2-yl)-2-phenyl-acetamide Formula: C27H21N3O3S3 MolecularWeight: 531.66894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=NC3=CC=CC=C3S2)SC4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=NC3=CC=CC=C3S2)SC4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H21N3O3S3/c31-26(29-27-28-23-13-7-8-14-24(23)35-27)25(19-9-3-1-4-10-19)34-21-17-15-20(16-18-21)30-36(32,33)22-11-5-2-6-12-22/h1-18,25,30H,(H,28,29,31)