ethyl 4-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[(3S)-1,1-dioxothiolan-3-yl]carbamothioylamino]benzoate CAS Name: 4-[[[[(3S)-1,1-dioxo-3-thiolanyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-1,1-dioxothiolan-3-yl]carbamothioylamino]benzoate Traditional Name: 4-[[(3S)-1,1-diketothiolan-3-yl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C14H18N2O4S2 MolecularWeight: 342.43372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2CCS(=O)(=O)C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)N[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C14H18N2O4S2/c1-2-20-13(17)10-3-5-11(6-4-10)15-14(21)16-12-7-8-22(18,19)9-12/h3-6,12H,2,7-9H2,1H3,(H2,15,16,21)/t12-/m0/s1