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

Systemtic Name: [4-[(E)-[(4-fluorophenyl)carbamothioylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-propoxybenzoate Openeye Name: [4-[(E)-[(4-fluorophenyl)carbamothioylhydrazono]methyl]-2-methoxy-phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-[(E)-[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(4-fluorophenyl)carbamothioylhydrazinylidene]methyl]-2-methoxyphenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-[(E)-[(4-fluorophenyl)thiocarbamoylhydrazono]methyl]-2-methoxy-phenyl] ester Formula: C25H24FN3O4S MolecularWeight: 481.539163

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=S)NC3=CC=C(C=C3)F)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=S)NC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C25H24FN3O4S/c1-3-14-32-21-11-5-18(6-12-21)24(30)33-22-13-4-17(15-23(22)31-2)16-27-29-25(34)28-20-9-7-19(26)8-10-20/h4-13,15-16H,3,14H2,1-2H3,(H2,28,29,34)/b27-16+