N-(2,4-dimethylphenyl)-N-[2-[[4-(1,3-oxazol-4-yl)phenyl]amino]-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)thiane-4-carboxamide

Systemtic Name: N-(2,4-dimethylphenyl)-N-[2-[[4-(1,3-oxazol-4-yl)phenyl]amino]-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)thiane-4-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-N-[2-(4-oxazol-4-ylanilino)-2-oxo-ethyl]-1,1-dioxo-thiane-4-carboxamide CAS Name: N-(2,4-dimethylphenyl)-N-[2-[4-(4-oxazolyl)anilino]-2-oxoethyl]-1,1-dioxo-4-thianecarboxamide IUPAC Name: N-(2,4-dimethylphenyl)-N-[2-[4-(1,3-oxazol-4-yl)anilino]-2-oxoethyl]-1,1-dioxothiane-4-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-1,1-diketo-N-[2-keto-2-(4-oxazol-4-ylanilino)ethyl]thiane-4-carboxamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)C3=COC=N3)C(=O)C4CCS(=O)(=O)CC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)C3=COC=N3)C(=O)C4CCS(=O)(=O)CC4)C

InChI

InChI=1S/C25H27N3O5S/c1-17-3-8-23(18(2)13-17)28(25(30)20-9-11-34(31,32)12-10-20)14-24(29)27-21-6-4-19(5-7-21)22-15-33-16-26-22/h3-8,13,15-16,20H,9-12,14H2,1-2H3,(H,27,29)