N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide Openeye Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide CAS Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-5-nitro-2-thiophenecarboxamide IUPAC Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-5-nitrothiophene-2-carboxamide Traditional Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide Formula: C18H19N3O4S2 MolecularWeight: 405.49116

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=CC(=CC(=C2SC1=NC(=O)C3=CC=C(S3)[N+](=O)[O-])C)C

Isomeric SMILES

CCOCCN1C2=CC(=CC(=C2SC1=NC(=O)C3=CC=C(S3)[N+](=O)[O-])C)C

InChI

InChI=1S/C18H19N3O4S2/c1-4-25-8-7-20-13-10-11(2)9-12(3)16(13)27-18(20)19-17(22)14-5-6-15(26-14)21(23)24/h5-6,9-10H,4,7-8H2,1-3H3