3-ethoxy-1-ethyl-N-[5-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide

Systemtic Name: 3-ethoxy-1-ethyl-N-[5-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Openeye Name: 3-ethoxy-1-ethyl-N-[5-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide CAS Name: 3-ethoxy-1-ethyl-N-[5-[[2-(4-nitroanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 3-ethoxy-1-ethyl-N-[5-[2-(4-nitroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Traditional Name: 3-ethoxy-1-ethyl-N-[5-[[2-keto-2-(4-nitroanilino)ethyl]thio]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Formula: C18H19N7O5S2 MolecularWeight: 477.51736

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)OCC)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)OCC)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N7O5S2/c1-3-24-9-13(16(23-24)30-4-2)15(27)20-17-21-22-18(32-17)31-10-14(26)19-11-5-7-12(8-6-11)25(28)29/h5-9H,3-4,10H2,1-2H3,(H,19,26)(H,20,21,27)