(E)-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[6-methylsulfonyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[6-mesyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-3-(2-thienyl)acrylamide Formula: C18H18N2O3S4 MolecularWeight: 438.60712

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C=CC3=CC=CS3

Isomeric SMILES

CSCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C18H18N2O3S4/c1-24-11-9-20-15-7-6-14(27(2,22)23)12-16(15)26-18(20)19-17(21)8-5-13-4-3-10-25-13/h3-8,10,12H,9,11H2,1-2H3/b8-5+,19-18?