N-(2-dimethylaminoethyl)-4-[ethyl(phenyl)sulfamoyl]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-[ethyl(phenyl)sulfamoyl]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-4-[ethyl(phenyl)sulfamoyl]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-4-[ethyl(phenyl)sulfamoyl]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-dimethylaminoethyl)-4-[ethyl(phenyl)sulfamoyl]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-4-[ethyl(phenyl)sulfamoyl]-N-(4-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C27H30N4O5S3 MolecularWeight: 586.7459

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN(C)C)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN(C)C)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C27H30N4O5S3/c1-5-31(21-10-7-6-8-11-21)39(35,36)22-16-14-20(15-17-22)26(32)30(19-18-29(2)3)27-28-25-23(37-27)12-9-13-24(25)38(4,33)34/h6-17H,5,18-19H2,1-4H3