N-[3-(dimethylamino)propyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide CAS Name: N-[3-(dimethylamino)propyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonylbenzamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonylbenzamide Traditional Name: N-[3-(dimethylamino)propyl]-3-esyl-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Formula: C23H29N3O3S2 MolecularWeight: 459.62466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN(C)C)C(=O)C3=CC(=CC=C3)S(=O)(=O)CC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN(C)C)C(=O)C3=CC(=CC=C3)S(=O)(=O)CC

InChI

InChI=1S/C23H29N3O3S2/c1-5-17-11-12-20-21(15-17)30-23(24-20)26(14-8-13-25(3)4)22(27)18-9-7-10-19(16-18)31(28,29)6-2/h7,9-12,15-16H,5-6,8,13-14H2,1-4H3