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

Systemtic Name: N-(2-diethylaminoethyl)-2-(4-ethylsulfanylphenyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(2-diethylaminoethyl)-2-(4-ethylsulfanylphenyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(2-diethylaminoethyl)-2-[4-(ethylthio)phenyl]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: N-(2-diethylaminoethyl)-2-(4-ethylsulfanylphenyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(2-diethylaminoethyl)-2-[4-(ethylthio)phenyl]-N-(4-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C24H31N3O3S3 MolecularWeight: 505.71624

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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)CC3=CC=C(C=C3)SCC

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)CC3=CC=C(C=C3)SCC

InChI

InChI=1S/C24H31N3O3S3/c1-5-26(6-2)15-16-27(22(28)17-18-11-13-19(14-12-18)31-7-3)24-25-23-20(32-24)9-8-10-21(23)33(4,29)30/h8-14H,5-7,15-17H2,1-4H3