N-(2-dimethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(phenylsulfonyl)ethanamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(phenylsulfonyl)ethanamide Openeye Name: 2-(benzenesulfonyl)-N-(2-dimethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(benzenesulfonyl)-N-(2-dimethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(benzenesulfonyl)-N-(2-dimethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-besyl-N-(2-dimethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CCN(C)C)C(=O)CS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CCN(C)C)C(=O)CS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H25N3O3S2/c1-15-12-16(2)20-18(13-15)28-21(22-20)24(11-10-23(3)4)19(25)14-29(26,27)17-8-6-5-7-9-17/h5-9,12-13H,10-11,14H2,1-4H3