3-(4-ethanoylphenyl)-6-oxidanylidene-8-phenyl-2,4-dihydropyrimido[2,1-b][1,3,5]thiadiazine-7-carbonitrile

Systemtic Name: 3-(4-ethanoylphenyl)-6-oxidanylidene-8-phenyl-2,4-dihydropyrimido[2,1-b][1,3,5]thiadiazine-7-carbonitrile Openeye Name: 3-(4-acetylphenyl)-6-oxo-8-phenyl-2,4-dihydropyrimido[2,1-b][1,3,5]thiadiazine-7-carbonitrile CAS Name: 3-(4-acetylphenyl)-6-oxo-8-phenyl-2,4-dihydropyrimido[2,1-b][1,3,5]thiadiazine-7-carbonitrile IUPAC Name: 3-(4-acetylphenyl)-6-oxo-8-phenyl-2,4-dihydropyrimido[2,1-b][1,3,5]thiadiazine-7-carbonitrile Traditional Name: 3-(4-acetylphenyl)-6-keto-8-phenyl-2,4-dihydropyrimido[2,1-b][1,3,5]thiadiazine-7-carbonitrile Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CN3C(=O)C(=C(N=C3SC2)C4=CC=CC=C4)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CN3C(=O)C(=C(N=C3SC2)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H16N4O2S/c1-14(26)15-7-9-17(10-8-15)24-12-25-20(27)18(11-22)19(23-21(25)28-13-24)16-5-3-2-4-6-16/h2-10H,12-13H2,1H3