N-[(E)-(3,5-ditert-butyl-4-methyl-phenyl)methylideneamino]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-(3,5-ditert-butyl-4-methyl-phenyl)methylideneamino]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-(3,5-ditert-butyl-4-methyl-phenyl)methyleneamino]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(E)-(3,5-ditert-butyl-4-methylphenyl)methylideneamino]-2-[(1-ethyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[(E)-(3,5-ditert-butyl-4-methylphenyl)methylideneamino]-2-(1-ethylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[(E)-(3,5-ditert-butyl-4-methyl-benzylidene)amino]-2-[(1-ethylbenzimidazol-2-yl)thio]acetamide Formula: C27H36N4OS MolecularWeight: 464.66594

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)NN=CC3=CC(=C(C(=C3)C(C)(C)C)C)C(C)(C)C

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)N/N=C/C3=CC(=C(C(=C3)C(C)(C)C)C)C(C)(C)C

InChI

InChI=1S/C27H36N4OS/c1-9-31-23-13-11-10-12-22(23)29-25(31)33-17-24(32)30-28-16-19-14-20(26(3,4)5)18(2)21(15-19)27(6,7)8/h10-16H,9,17H2,1-8H3,(H,30,32)/b28-16+