N-(2-dimethylaminoethyl)-2-(4-ethylsulfanylphenyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-(4-ethylsulfanylphenyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(2-dimethylaminoethyl)-2-(4-ethylsulfanylphenyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(2-dimethylaminoethyl)-2-[4-(ethylthio)phenyl]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: N-(2-dimethylaminoethyl)-2-(4-ethylsulfanylphenyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(2-dimethylaminoethyl)-2-[4-(ethylthio)phenyl]-N-(4-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C22H27N3O3S3 MolecularWeight: 477.66308

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)CC(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=C(C=C1)CC(=O)N(CCN(C)C)C2=NC3=C(S2)C=CC=C3S(=O)(=O)C

InChI

InChI=1S/C22H27N3O3S3/c1-5-29-17-11-9-16(10-12-17)15-20(26)25(14-13-24(2)3)22-23-21-18(30-22)7-6-8-19(21)31(4,27)28/h6-12H,5,13-15H2,1-4H3