6-(3-nitrophenyl)-2-pentan-3-yl-imidazo[2,1-b][1,3,4]thiadiazole-5-carbaldehyde

Systemtic Name: 6-(3-nitrophenyl)-2-pentan-3-yl-imidazo[2,1-b][1,3,4]thiadiazole-5-carbaldehyde Openeye Name: 2-(1-ethylpropyl)-6-(3-nitrophenyl)imidazo[2,1-b][1,3,4]thiadiazole-5-carbaldehyde CAS Name: 6-(3-nitrophenyl)-2-pentan-3-yl-5-imidazo[2,1-b][1,3,4]thiadiazolecarboxaldehyde IUPAC Name: 6-(3-nitrophenyl)-2-pentan-3-ylimidazo[2,1-b][1,3,4]thiadiazole-5-carbaldehyde Traditional Name: 2-(1-ethylpropyl)-6-(3-nitrophenyl)imidazo[2,1-b][1,3,4]thiadiazole-5-carbaldehyde Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN2C(=C(N=C2S1)C3=CC(=CC=C3)[N+](=O)[O-])C=O

Isomeric SMILES

CCC(CC)C1=NN2C(=C(N=C2S1)C3=CC(=CC=C3)[N+](=O)[O-])C=O

InChI

InChI=1S/C16H16N4O3S/c1-3-10(4-2)15-18-19-13(9-21)14(17-16(19)24-15)11-6-5-7-12(8-11)20(22)23/h5-10H,3-4H2,1-2H3