S-[(3-chloranyl-4-ethyl-phenyl)amino] N-(5-oxidanylidene-2H-furan-3-yl)carbamothioate

Systemtic Name: S-[(3-chloranyl-4-ethyl-phenyl)amino] N-(5-oxidanylidene-2H-furan-3-yl)carbamothioate Openeye Name: S-(3-chloro-4-ethyl-anilino) N-(5-oxo-2H-furan-3-yl)carbamothioate CAS Name: N-(5-oxo-2H-furan-3-yl)carbamothioic acid S-(3-chloro-4-ethylanilino) ester IUPAC Name: S-(3-chloro-4-ethylanilino) N-(5-oxo-2H-furan-3-yl)carbamothioate Traditional Name: N-(5-keto-2H-furan-3-yl)thiocarbamic acid S-(3-chloro-4-ethyl-anilino) ester Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NSC(=O)NC2=CC(=O)OC2)Cl

Isomeric SMILES

CCC1=C(C=C(C=C1)NSC(=O)NC2=CC(=O)OC2)Cl

InChI

InChI=1S/C13H13ClN2O3S/c1-2-8-3-4-9(5-11(8)14)16-20-13(18)15-10-6-12(17)19-7-10/h3-6,16H,2,7H2,1H3,(H,15,18)