3-(4-fluorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]propanamide Openeye Name: 3-(4-fluorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]propanamide CAS Name: 3-[(4-fluorophenyl)thio]-N-[6-methylsulfonyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]propanamide IUPAC Name: 3-(4-fluorophenyl)sulfanyl-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]propanamide Traditional Name: 3-[(4-fluorophenyl)thio]-N-[6-mesyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]propionamide Formula: C20H21FN2O3S4 MolecularWeight: 484.650743

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

CSCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O3S4/c1-27-12-10-23-17-8-7-16(30(2,25)26)13-18(17)29-20(23)22-19(24)9-11-28-15-5-3-14(21)4-6-15/h3-8,13H,9-12H2,1-2H3