5-[[1,1-bis(oxidanylidene)thiolan-3-yl]amino]-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[[1,1-bis(oxidanylidene)thiolan-3-yl]amino]-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[(1,1-dioxothiolan-3-yl)amino]-2-(2-nitrophenyl)oxazole-4-carbonitrile CAS Name: 5-[(1,1-dioxo-3-thiolanyl)amino]-2-(2-nitrophenyl)-4-oxazolecarbonitrile IUPAC Name: 5-[(1,1-dioxothiolan-3-yl)amino]-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[(1,1-diketothiolan-3-yl)amino]-2-(2-nitrophenyl)oxazole-4-carbonitrile Formula: C14H12N4O5S MolecularWeight: 348.33388

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC2=C(N=C(O2)C3=CC=CC=C3[N+](=O)[O-])C#N

Isomeric SMILES

C1CS(=O)(=O)CC1NC2=C(N=C(O2)C3=CC=CC=C3[N+](=O)[O-])C#N

InChI

InChI=1S/C14H12N4O5S/c15-7-11-14(16-9-5-6-24(21,22)8-9)23-13(17-11)10-3-1-2-4-12(10)18(19)20/h1-4,9,16H,5-6,8H2