(E)-N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-3-(5-nitrothiophen-2-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-3-(5-nitrothiophen-2-yl)prop-2-enamide Openeye Name: (E)-N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-3-(5-nitro-2-thienyl)prop-2-enamide CAS Name: (E)-N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-3-(5-nitro-2-thiophenyl)-2-propenamide IUPAC Name: (E)-N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-3-(5-nitrothiophen-2-yl)prop-2-enamide Traditional Name: (E)-N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-3-(5-nitro-2-thienyl)acrylamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC=C2SC1=NC(=O)C=CC3=CC=C(S3)[N+](=O)[O-])OCC

Isomeric SMILES

CCN1C2=C(C=CC=C2SC1=NC(=O)/C=C/C3=CC=C(S3)[N+](=O)[O-])OCC

InChI

InChI=1S/C18H17N3O4S2/c1-3-20-17-13(25-4-2)6-5-7-14(17)27-18(20)19-15(22)10-8-12-9-11-16(26-12)21(23)24/h5-11H,3-4H2,1-2H3/b10-8+,19-18?