[4-[(Z)-(1-butyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] propanoate

Systemtic Name: [4-[(Z)-(1-butyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] propanoate Openeye Name: [4-[(Z)-(1-butyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] propanoate CAS Name: propanoic acid [4-[(Z)-(1-butyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]phenyl] ester IUPAC Name: [4-[(Z)-(1-butyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl] propanoate Traditional Name: propionic acid [4-[(Z)-(1-butyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] ester Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)CC)NC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C/C2=CC=C(C=C2)OC(=O)CC)/NC1=S

InChI

InChI=1S/C17H20N2O3S/c1-3-5-10-19-16(21)14(18-17(19)23)11-12-6-8-13(9-7-12)22-15(20)4-2/h6-9,11H,3-5,10H2,1-2H3,(H,18,23)/b14-11-