4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(2,4-ditert-amylphenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)butyramide Formula: C29H40N2O2S MolecularWeight: 480.7051

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=NC3=C(C=C(C=C3S2)C)C)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=NC3=C(C=C(C=C3S2)C)C)C(C)(C)CC

InChI

InChI=1S/C29H40N2O2S/c1-9-28(5,6)21-13-14-23(22(18-21)29(7,8)10-2)33-15-11-12-25(32)30-27-31-26-20(4)16-19(3)17-24(26)34-27/h13-14,16-18H,9-12,15H2,1-8H3,(H,30,31,32)