N-(3-ethyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-4-propan-2-ylsulfonyl-benzamide

Systemtic Name: N-(3-ethyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-4-propan-2-ylsulfonyl-benzamide Openeye Name: N-(3-ethyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-4-isopropylsulfonyl-benzamide CAS Name: N-[3-ethyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-4-propan-2-ylsulfonylbenzamide IUPAC Name: N-(3-ethyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-4-propan-2-ylsulfonylbenzamide Traditional Name: N-[3-ethyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-4-isopropylsulfonyl-benzamide Formula: C20H22N2O3S3 MolecularWeight: 434.59528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C20H22N2O3S3/c1-5-22-17-11-8-15(26-4)12-18(17)27-20(22)21-19(23)14-6-9-16(10-7-14)28(24,25)13(2)3/h6-13H,5H2,1-4H3