N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,2-diphenyl-ethanamide

Systemtic Name: N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,2-diphenyl-ethanamide Openeye Name: N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,2-diphenyl-acetamide CAS Name: N-[5,6-dimethyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-2,2-diphenylacetamide IUPAC Name: N-[5,6-dimethyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2,2-diphenylacetamide Traditional Name: N-[5,6-dimethyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-2,2-diphenyl-acetamide Formula: C26H26N2OS2 MolecularWeight: 446.62744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N2CCSC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)N2CCSC

InChI

InChI=1S/C26H26N2OS2/c1-18-16-22-23(17-19(18)2)31-26(28(22)14-15-30-3)27-25(29)24(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,16-17,24H,14-15H2,1-3H3