2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-propan-2-yloxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-propan-2-yloxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-isopropoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-(3-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-(3-ethoxy-4-isopropoxy-benzylidene)amino]acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3N2)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3N2)OC(C)C

InChI

InChI=1S/C21H24N4O3S/c1-4-27-19-11-15(9-10-18(19)28-14(2)3)12-22-25-20(26)13-29-21-23-16-7-5-6-8-17(16)24-21/h5-12,14H,4,13H2,1-3H3,(H,23,24)(H,25,26)/b22-12+