4-(1,3-benzothiazol-2-yl)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]butyramide Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H25N3O4S2/c1-4-28-17-13-12-15(14-19(17)30(26,27)24(2)3)22-20(25)10-7-11-21-23-16-8-5-6-9-18(16)29-21/h5-6,8-9,12-14H,4,7,10-11H2,1-3H3,(H,22,25)