[4-[(butylcarbamothioylhydrazinylidene)methyl]phenyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [4-[(butylcarbamothioylhydrazinylidene)methyl]phenyl] 3,4,5-trimethoxybenzoate Openeye Name: [4-[(butylcarbamothioylhydrazono)methyl]phenyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [4-[[[butylamino(sulfanylidene)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(butylcarbamothioylhydrazinylidene)methyl]phenyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [4-[(butylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S/c1-5-6-11-23-22(31)25-24-14-15-7-9-17(10-8-15)30-21(26)16-12-18(27-2)20(29-4)19(13-16)28-3/h7-10,12-14H,5-6,11H2,1-4H3,(H2,23,25,31)