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

Systemtic Name: (E)-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[3-[2-(methylthio)ethyl]-6-nitro-1,3-benzothiazol-2-ylidene]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[3-(2-methylsulfanylethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[3-[2-(methylthio)ethyl]-6-nitro-1,3-benzothiazol-2-ylidene]-3-(2-thienyl)acrylamide Formula: C17H15N3O3S3 MolecularWeight: 405.5143

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C=CC3=CC=CS3

Isomeric SMILES

CSCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C17H15N3O3S3/c1-24-10-8-19-14-6-4-12(20(22)23)11-15(14)26-17(19)18-16(21)7-5-13-3-2-9-25-13/h2-7,9,11H,8,10H2,1H3/b7-5+,18-17?