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

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-benzamide hydrochloride Openeye Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonyl-benzamide hydrochloride CAS Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide hydrochloride IUPAC Name: N-[3-(dimethylamino)propyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-methylsulfonylbenzamide hydrochloride Traditional Name: N-[3-(dimethylamino)propyl]-2-mesyl-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide hydrochloride Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

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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=CC=C3S(=O)(=O)C.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CCCN(C)C)C(=O)C3=CC=CC=C3S(=O)(=O)C.Cl

InChI

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