4-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]-N-(furan-2-ylmethyl)piperidine-1-carbothioamide

Systemtic Name: 4-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]-N-(furan-2-ylmethyl)piperidine-1-carbothioamide Openeye Name: 4-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]-N-(2-furylmethyl)piperidine-1-carbothioamide CAS Name: 4-[4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-thiazolyl]-N-(2-furanylmethyl)-1-piperidinecarbothioamide IUPAC Name: 4-[4-(3,5-ditert-butyl-4-hydroxyphenyl)-1,3-thiazol-2-yl]-N-(furan-2-ylmethyl)piperidine-1-carbothioamide Traditional Name: 4-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]-N-(2-furfuryl)piperidine-1-carbothioamide Formula: C28H37N3O2S2 MolecularWeight: 511.74228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)C3CCN(CC3)C(=S)NCC4=CC=CO4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)C3CCN(CC3)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C28H37N3O2S2/c1-27(2,3)21-14-19(15-22(24(21)32)28(4,5)6)23-17-35-25(30-23)18-9-11-31(12-10-18)26(34)29-16-20-8-7-13-33-20/h7-8,13-15,17-18,32H,9-12,16H2,1-6H3,(H,29,34)