[2-methoxy-4-[(Z)-(3-morpholin-4-ylpropylcarbamothioylhydrazinylidene)methyl]phenyl] thiophene-2-carboxylate

Systemtic Name: [2-methoxy-4-[(Z)-(3-morpholin-4-ylpropylcarbamothioylhydrazinylidene)methyl]phenyl] thiophene-2-carboxylate Openeye Name: [2-methoxy-4-[(Z)-(3-morpholinopropylcarbamothioylhydrazono)methyl]phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-methoxy-4-[(Z)-[[[3-(4-morpholinyl)propylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-(3-morpholin-4-ylpropylcarbamothioylhydrazinylidene)methyl]phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-methoxy-4-[(Z)-(3-morpholinopropylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NCCCN2CCOCC2)OC(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\NC(=S)NCCCN2CCOCC2)OC(=O)C3=CC=CS3

InChI

InChI=1S/C21H26N4O4S2/c1-27-18-14-16(5-6-17(18)29-20(26)19-4-2-13-31-19)15-23-24-21(30)22-7-3-8-25-9-11-28-12-10-25/h2,4-6,13-15H,3,7-12H2,1H3,(H2,22,24,30)/b23-15-