dimethyl 2-[[(E)-1-(1,3-thiazol-2-yl)ethylideneamino]carbamothioylamino]pentanedioate

Systemtic Name: dimethyl 2-[[(E)-1-(1,3-thiazol-2-yl)ethylideneamino]carbamothioylamino]pentanedioate Openeye Name: dimethyl 2-[[(E)-1-thiazol-2-ylethylideneamino]carbamothioylamino]pentanedioate CAS Name: 2-[[sulfanylidene-[(2E)-2-[1-(2-thiazolyl)ethylidene]hydrazinyl]methyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[(E)-1-(1,3-thiazol-2-yl)ethylideneamino]carbamothioylamino]pentanedioate Traditional Name: 2-[[(E)-1-thiazol-2-ylethylideneamino]thiocarbamoylamino]glutaric acid dimethyl ester Formula: C13H18N4O4S2 MolecularWeight: 358.43642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC(CCC(=O)OC)C(=O)OC)C1=NC=CS1

Isomeric SMILES

C/C(=N\NC(=S)NC(CCC(=O)OC)C(=O)OC)/C1=NC=CS1

InChI

InChI=1S/C13H18N4O4S2/c1-8(11-14-6-7-23-11)16-17-13(22)15-9(12(19)21-3)4-5-10(18)20-2/h6-7,9H,4-5H2,1-3H3,(H2,15,17,22)/b16-8+