5-(1,3-benzothiazol-2-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)pentanamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)pentanamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)pentanamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methoxy-3-sulfamoylphenyl)pentanamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methoxy-3-sulfamoylphenyl)pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)valeramide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N

InChI

InChI=1S/C19H21N3O4S2/c1-26-15-11-10-13(12-17(15)28(20,24)25)21-18(23)8-4-5-9-19-22-14-6-2-3-7-16(14)27-19/h2-3,6-7,10-12H,4-5,8-9H2,1H3,(H,21,23)(H2,20,24,25)