2-[5-oxidanylidene-3-(oxolan-2-ylmethyl)-1-phenyl-2-sulfanylidene-imidazolidin-4-yl]ethanoic acid

Systemtic Name: 2-[5-oxidanylidene-3-(oxolan-2-ylmethyl)-1-phenyl-2-sulfanylidene-imidazolidin-4-yl]ethanoic acid Openeye Name: 2-[5-oxo-1-phenyl-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-imidazolidin-4-yl]acetic acid CAS Name: 2-[5-oxo-3-(2-oxolanylmethyl)-1-phenyl-2-sulfanylidene-4-imidazolidinyl]acetic acid IUPAC Name: 2-[5-oxo-3-(oxolan-2-ylmethyl)-1-phenyl-2-sulfanylideneimidazolidin-4-yl]acetic acid Traditional Name: 2-[5-keto-1-phenyl-3-(tetrahydrofurfuryl)-2-thioxo-imidazolidin-4-yl]acetic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(C(=O)N(C2=S)C3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C1CC(OC1)CN2C(C(=O)N(C2=S)C3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C16H18N2O4S/c19-14(20)9-13-15(21)18(11-5-2-1-3-6-11)16(23)17(13)10-12-7-4-8-22-12/h1-3,5-6,12-13H,4,7-10H2,(H,19,20)