2-(4-chlorophenyl)sulfanyl-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-(2-diethylaminoethyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-(2-diethylaminoethyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C22H26ClN3O3S3 MolecularWeight: 512.10814

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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)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN3O3S3/c1-4-25(5-2)12-13-26(21(27)15-30-17-8-6-16(23)7-9-17)22-24-19-11-10-18(32(3,28)29)14-20(19)31-22/h6-11,14H,4-5,12-13,15H2,1-3H3