(E)-2-(1H-benzimidazol-2-yl)-3-(4-methylsulfanylphenyl)-1-morpholin-4-yl-prop-2-en-1-one

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-methylsulfanylphenyl)-1-morpholin-4-yl-prop-2-en-1-one Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-methylsulfanylphenyl)-1-morpholino-prop-2-en-1-one CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[4-(methylthio)phenyl]-1-(4-morpholinyl)-2-propen-1-one IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-methylsulfanylphenyl)-1-morpholin-4-ylprop-2-en-1-one Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[4-(methylthio)phenyl]-1-morpholino-prop-2-en-1-one Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)N4CCOCC4

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C(\C2=NC3=CC=CC=C3N2)/C(=O)N4CCOCC4

InChI

InChI=1S/C21H21N3O2S/c1-27-16-8-6-15(7-9-16)14-17(21(25)24-10-12-26-13-11-24)20-22-18-4-2-3-5-19(18)23-20/h2-9,14H,10-13H2,1H3,(H,22,23)/b17-14+