4-ethoxy-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-ethoxy-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-ethoxy-N-[5-[(E)-(5-nitro-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-ethoxy-N-[5-[(E)-(5-nitro-2-thiophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-ethoxy-N-[5-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-ethoxy-N-[5-[(E)-(5-nitro-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H13N5O4S2 MolecularWeight: 403.43552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)N=CC3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)/N=C/C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O4S2/c1-2-25-11-5-3-10(4-6-11)14(22)18-16-20-19-15(27-16)17-9-12-7-8-13(26-12)21(23)24/h3-9H,2H2,1H3,(H,18,20,22)/b17-9+