4-[[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]methyl-methyl-amino]butanenitrile

Systemtic Name: 4-[[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]methyl-methyl-amino]butanenitrile Openeye Name: 4-[[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]methyl-methyl-amino]butanenitrile CAS Name: 4-[[4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-thiazolyl]methyl-methylamino]butanenitrile IUPAC Name: 4-[[4-(3,5-ditert-butyl-4-hydroxyphenyl)-1,3-thiazol-2-yl]methyl-methylamino]butanenitrile Traditional Name: 4-[[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]methyl-methyl-amino]butyronitrile Formula: C23H33N3OS MolecularWeight: 399.59262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)CN(C)CCCC#N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)CN(C)CCCC#N

InChI

InChI=1S/C23H33N3OS/c1-22(2,3)17-12-16(13-18(21(17)27)23(4,5)6)19-15-28-20(25-19)14-26(7)11-9-8-10-24/h12-13,15,27H,8-9,11,14H2,1-7H3