3-chloranyl-N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-chloranyl-N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3-chloro-N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-chloro-N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-chloro-N-(2-diethylaminoethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-chloro-N-(2-diethylaminoethyl)-N-(4-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H24ClN3O3S2 MolecularWeight: 466.01656

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H24ClN3O3S2/c1-4-24(5-2)12-13-25(20(26)15-8-6-9-16(22)14-15)21-23-19-17(29-21)10-7-11-18(19)30(3,27)28/h6-11,14H,4-5,12-13H2,1-3H3