dimethyl 2-[[(E)-1-pyrazin-2-ylethylideneamino]carbamothioylamino]pentanedioate

Systemtic Name: dimethyl 2-[[(E)-1-pyrazin-2-ylethylideneamino]carbamothioylamino]pentanedioate Openeye Name: dimethyl 2-[[(E)-1-pyrazin-2-ylethylideneamino]carbamothioylamino]pentanedioate CAS Name: 2-[[[(2E)-2-[1-(2-pyrazinyl)ethylidene]hydrazinyl]-sulfanylidenemethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[(E)-1-pyrazin-2-ylethylideneamino]carbamothioylamino]pentanedioate Traditional Name: 2-[[(E)-1-pyrazin-2-ylethylideneamino]thiocarbamoylamino]glutaric acid dimethyl ester Formula: C14H19N5O4S MolecularWeight: 353.39676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC(CCC(=O)OC)C(=O)OC)C1=NC=CN=C1

Isomeric SMILES

C/C(=N\NC(=S)NC(CCC(=O)OC)C(=O)OC)/C1=NC=CN=C1

InChI

InChI=1S/C14H19N5O4S/c1-9(11-8-15-6-7-16-11)18-19-14(24)17-10(13(21)23-3)4-5-12(20)22-2/h6-8,10H,4-5H2,1-3H3,(H2,17,19,24)/b18-9+