ethyl 5-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1,2,3-thiadiazole-4-carboxylate

Systemtic Name: ethyl 5-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]-1,2,3-thiadiazole-4-carboxylate Openeye Name: ethyl 5-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]thiadiazole-4-carboxylate CAS Name: 5-[[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]amino]-4-thiadiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]thiadiazole-4-carboxylate Traditional Name: 5-[[(E)-3-(2-nitrophenyl)acryloyl]amino]thiadiazole-4-carboxylic acid ethyl ester Formula: C14H12N4O5S MolecularWeight: 348.33388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=N1)NC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SN=N1)NC(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O5S/c1-2-23-14(20)12-13(24-17-16-12)15-11(19)8-7-9-5-3-4-6-10(9)18(21)22/h3-8H,2H2,1H3,(H,15,19)/b8-7+