2-[2-bromanyl-6-ethoxy-4-[[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenoxy]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[2-bromanyl-6-ethoxy-4-[[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenoxy]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[(benzylcarbamothioylhydrazono)methyl]-2-bromo-6-ethoxy-phenoxy]-N,N-dimethyl-acetamide CAS Name: 2-[2-bromo-6-ethoxy-4-[[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]-N,N-dimethylacetamide IUPAC Name: 2-[4-[(benzylcarbamothioylhydrazinylidene)methyl]-2-bromo-6-ethoxyphenoxy]-N,N-dimethylacetamide Traditional Name: 2-[4-[(benzylthiocarbamoylhydrazono)methyl]-2-bromo-6-ethoxy-phenoxy]-N,N-dimethyl-acetamide Formula: C21H25BrN4O3S MolecularWeight: 493.4172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=S)NCC2=CC=CC=C2)Br)OCC(=O)N(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=S)NCC2=CC=CC=C2)Br)OCC(=O)N(C)C

InChI

InChI=1S/C21H25BrN4O3S/c1-4-28-18-11-16(10-17(22)20(18)29-14-19(27)26(2)3)13-24-25-21(30)23-12-15-8-6-5-7-9-15/h5-11,13H,4,12,14H2,1-3H3,(H2,23,25,30)