2,5-bis(chloranyl)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2,5-bis(chloranyl)-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2,5-dichloro-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 2,5-dichloro-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2,5-dichloro-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2,5-dichloro-N-(2-diethylaminoethyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H23Cl2N3O3S2 MolecularWeight: 500.46162

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O3S2/c1-4-25(5-2)10-11-26(20(27)16-12-14(22)6-8-17(16)23)21-24-18-9-7-15(31(3,28)29)13-19(18)30-21/h6-9,12-13H,4-5,10-11H2,1-3H3