[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-propoxybenzoate

Systemtic Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-propoxybenzoate Openeye Name: [4-[(E)-(carbamothioylhydrazono)methyl]-2-methoxy-phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-methoxy-4-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C19H21N3O4S MolecularWeight: 387.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=S)N)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=S)N)OC

InChI

InChI=1S/C19H21N3O4S/c1-3-10-25-15-7-5-14(6-8-15)18(23)26-16-9-4-13(11-17(16)24-2)12-21-22-19(20)27/h4-9,11-12H,3,10H2,1-2H3,(H3,20,22,27)/b21-12+