methyl 2-chloranyl-5-[5-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 2-chloranyl-5-[5-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 2-chloro-5-[5-[(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]-2-furyl]benzoate CAS Name: 2-chloro-5-[5-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[5-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]furan-2-yl]benzoate Traditional Name: 2-chloro-5-[5-[(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]-2-furyl]benzoic acid methyl ester Formula: C16H11ClN2O4S MolecularWeight: 362.78754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)NC(=S)N3)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)NC(=S)N3)Cl

InChI

InChI=1S/C16H11ClN2O4S/c1-22-15(21)10-6-8(2-4-11(10)17)13-5-3-9(23-13)7-12-14(20)19-16(24)18-12/h2-7H,1H3,(H2,18,19,20,24)