(2E)-2-(5-ethanoyl-3-phenyl-1,3,4-thiadiazol-2-ylidene)-3-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanal

Systemtic Name: (2E)-2-(5-ethanoyl-3-phenyl-1,3,4-thiadiazol-2-ylidene)-3-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanal Openeye Name: (2E)-2-(5-acetyl-3-phenyl-1,3,4-thiadiazol-2-ylidene)-3-(1-methylbenzimidazol-2-yl)-3-oxo-propanal CAS Name: (2E)-2-(5-acetyl-3-phenyl-1,3,4-thiadiazol-2-ylidene)-3-(1-methyl-2-benzimidazolyl)-3-oxopropanal IUPAC Name: (2E)-2-(5-acetyl-3-phenyl-1,3,4-thiadiazol-2-ylidene)-3-(1-methylbenzimidazol-2-yl)-3-oxopropanal Traditional Name: (2E)-2-(5-acetyl-3-phenyl-1,3,4-thiadiazol-2-ylidene)-3-keto-3-(1-methylbenzimidazol-2-yl)propionaldehyde Formula: C21H16N4O3S MolecularWeight: 404.44174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=C(C=O)C(=O)C2=NC3=CC=CC=C3N2C)S1)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=NN(/C(=C(/C=O)\C(=O)C2=NC3=CC=CC=C3N2C)/S1)C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O3S/c1-13(27)20-23-25(14-8-4-3-5-9-14)21(29-20)15(12-26)18(28)19-22-16-10-6-7-11-17(16)24(19)2/h3-12H,1-2H3/b21-15+