N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-benzamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-benzamide CAS Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonylbenzamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfonylbenzamide Traditional Name: N-[3-(dimethylamino)propyl]-4-mesyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CCCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H25N3O3S2/c1-15-6-11-18-19(14-15)28-21(22-18)24(13-5-12-23(2)3)20(25)16-7-9-17(10-8-16)29(4,26)27/h6-11,14H,5,12-13H2,1-4H3