N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonyl-benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonyl-benzamide Openeye Name: N-(2-dimethylaminoethyl)-3-isopropylsulfonyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonylbenzamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-3-propan-2-ylsulfonylbenzamide Traditional Name: N-(2-dimethylaminoethyl)-3-isopropylsulfonyl-N-(4-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C22H27N3O5S3 MolecularWeight: 509.66188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3S(=O)(=O)C

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3S(=O)(=O)C

InChI

InChI=1S/C22H27N3O5S3/c1-15(2)33(29,30)17-9-6-8-16(14-17)21(26)25(13-12-24(3)4)22-23-20-18(31-22)10-7-11-19(20)32(5,27)28/h6-11,14-15H,12-13H2,1-5H3