N-(2-diethylaminoethyl)-3-ethylsulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-3-ethylsulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-diethylaminoethyl)-3-ethylsulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-diethylaminoethyl)-3-ethylsulfonyl-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: N-(2-diethylaminoethyl)-3-ethylsulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-diethylaminoethyl)-3-esyl-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C23H29N3O3S3 MolecularWeight: 491.68966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2SC)C(=O)C3=CC(=CC=C3)S(=O)(=O)CC

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2SC)C(=O)C3=CC(=CC=C3)S(=O)(=O)CC

InChI

InChI=1S/C23H29N3O3S3/c1-5-25(6-2)14-15-26(23-24-21-19(30-4)12-9-13-20(21)31-23)22(27)17-10-8-11-18(16-17)32(28,29)7-3/h8-13,16H,5-7,14-15H2,1-4H3