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

Systemtic Name: [4-[(E)-(1-butyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenyl] cyclopropanecarboxylate Openeye Name: [4-[(E)-(1-butyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [4-[(E)-(1-butyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(1-butyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenyl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [4-[(E)-(1-butyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]phenyl] ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3CC3)NC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C\C2=CC=C(C=C2)OC(=O)C3CC3)/NC1=S

InChI

InChI=1S/C18H20N2O3S/c1-2-3-10-20-16(21)15(19-18(20)24)11-12-4-8-14(9-5-12)23-17(22)13-6-7-13/h4-5,8-9,11,13H,2-3,6-7,10H2,1H3,(H,19,24)/b15-11+