4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxy-phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxy-phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxy-phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxy-phenyl]butyramide Formula: C26H27N3O4S3 MolecularWeight: 541.70528

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C26H27N3O4S3/c1-3-29(19-10-5-4-6-11-19)36(31,32)20-15-16-23(33-2)22(18-20)27-25(30)14-9-17-34-26-28-21-12-7-8-13-24(21)35-26/h4-8,10-13,15-16,18H,3,9,14,17H2,1-2H3,(H,27,30)