[4-bromanyl-2-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]phenyl] 3,4-dimethoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]phenyl] 3,4-dimethoxybenzoate Openeye Name: [4-bromo-2-[(E)-(ethylcarbamothioylhydrazono)methyl]phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [4-bromo-2-[(E)-[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]phenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [4-bromo-2-[(E)-(ethylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C19H20BrN3O4S MolecularWeight: 466.3488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(C=CC(=C1)Br)OC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCNC(=S)N/N=C/C1=C(C=CC(=C1)Br)OC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H20BrN3O4S/c1-4-21-19(28)23-22-11-13-9-14(20)6-8-15(13)27-18(24)12-5-7-16(25-2)17(10-12)26-3/h5-11H,4H2,1-3H3,(H2,21,23,28)/b22-11+