[4-[[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylhydrazinylidene]methyl]-2-ethoxy-phenyl] 3-methoxybenzoate

Systemtic Name: [4-[[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylhydrazinylidene]methyl]-2-ethoxy-phenyl] 3-methoxybenzoate Openeye Name: [4-[[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazono]methyl]-2-ethoxy-phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]hydrazinylidene]methyl]-2-ethoxyphenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-[[[2-(1,3-benzoxazol-2-ylthio)acetyl]hydrazono]methyl]-2-ethoxy-phenyl] ester Formula: C26H23N3O6S MolecularWeight: 505.54232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3O2)OC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3O2)OC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H23N3O6S/c1-3-33-23-13-17(11-12-22(23)34-25(31)18-7-6-8-19(14-18)32-2)15-27-29-24(30)16-36-26-28-20-9-4-5-10-21(20)35-26/h4-15H,3,16H2,1-2H3,(H,29,30)