N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C22H19N3O4S3 MolecularWeight: 485.59896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3O4S3/c1-29-16-9-12-19-20(13-16)31-22(23-19)24-21(26)14-30-17-10-7-15(8-11-17)25-32(27,28)18-5-3-2-4-6-18/h2-13,25H,14H2,1H3,(H,23,24,26)