4-[(1,3-benzothiazol-2-ylamino)-diethoxyphosphoryl-methyl]-2,6-ditert-butyl-phenol

Systemtic Name: 4-[(1,3-benzothiazol-2-ylamino)-diethoxyphosphoryl-methyl]-2,6-ditert-butyl-phenol Openeye Name: 4-[(1,3-benzothiazol-2-ylamino)-diethoxyphosphoryl-methyl]-2,6-ditert-butyl-phenol CAS Name: 4-[(1,3-benzothiazol-2-ylamino)-diethoxyphosphorylmethyl]-2,6-ditert-butylphenol IUPAC Name: 4-[(1,3-benzothiazol-2-ylamino)-diethoxyphosphorylmethyl]-2,6-ditert-butylphenol Traditional Name: 4-[(1,3-benzothiazol-2-ylamino)-diethoxyphosphoryl-methyl]-2,6-ditert-butyl-phenol Formula: C26H37N2O4PS MolecularWeight: 504.621741

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)NC2=NC3=CC=CC=C3S2)OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)NC2=NC3=CC=CC=C3S2)OCC

InChI

InChI=1S/C26H37N2O4PS/c1-9-31-33(30,32-10-2)23(28-24-27-20-13-11-12-14-21(20)34-24)17-15-18(25(3,4)5)22(29)19(16-17)26(6,7)8/h11-16,23,29H,9-10H2,1-8H3,(H,27,28)