methyl 6-[[(Z)-1-(furan-2-yl)ethylideneamino]carbamothioylamino]hexanoate

Systemtic Name: methyl 6-[[(Z)-1-(furan-2-yl)ethylideneamino]carbamothioylamino]hexanoate Openeye Name: methyl 6-[[(Z)-1-(2-furyl)ethylideneamino]carbamothioylamino]hexanoate CAS Name: 6-[[[(2Z)-2-[1-(2-furanyl)ethylidene]hydrazinyl]-sulfanylidenemethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(Z)-1-(furan-2-yl)ethylideneamino]carbamothioylamino]hexanoate Traditional Name: 6-[[(Z)-1-(2-furyl)ethylideneamino]thiocarbamoylamino]hexanoic acid methyl ester Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCCCCC(=O)OC)C1=CC=CO1

Isomeric SMILES

C/C(=N/NC(=S)NCCCCCC(=O)OC)/C1=CC=CO1

InChI

InChI=1S/C14H21N3O3S/c1-11(12-7-6-10-20-12)16-17-14(21)15-9-5-3-4-8-13(18)19-2/h6-7,10H,3-5,8-9H2,1-2H3,(H2,15,17,21)/b16-11-