N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-tert-butylphenyl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-tert-butylphenyl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-5-phenyl-isoxazole-3-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-N-(1,1-dioxo-3-thiolanyl)-5-phenyl-3-isoxazolecarboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-N-(1,1-diketothiolan-3-yl)-5-phenyl-isoxazole-3-carboxamide Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O4S/c1-25(2,3)20-11-9-18(10-12-20)16-27(21-13-14-32(29,30)17-21)24(28)22-15-23(31-26-22)19-7-5-4-6-8-19/h4-12,15,21H,13-14,16-17H2,1-3H3