N-[3-(2-ethoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-[3-(2-ethoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide Openeye Name: N-[3-(2-ethoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide CAS Name: N-[3-(2-ethoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-5-nitro-2-thiophenecarboxamide IUPAC Name: N-[3-(2-ethoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-5-nitrothiophene-2-carboxamide Traditional Name: N-[3-(2-ethoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-5-nitro-thiophene-2-carboxamide Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4S2/c1-3-24-10-9-19-15-11(2)5-4-6-12(15)26-17(19)18-16(21)13-7-8-14(25-13)20(22)23/h4-8H,3,9-10H2,1-2H3