prop-2-ynyl (NE)-N-[3-[(6-chloranylpyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene]carbamate

Systemtic Name: prop-2-ynyl (NE)-N-[3-[(6-chloranylpyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene]carbamate Openeye Name: prop-2-ynyl (NE)-N-[3-[(6-chloro-3-pyridyl)methyl]thiazolidin-2-ylidene]carbamate CAS Name: (NE)-N-[3-[(6-chloro-3-pyridinyl)methyl]-2-thiazolidinylidene]carbamic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl (NE)-N-[3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene]carbamate Traditional Name: (NE)-N-[3-[(6-chloro-3-pyridyl)methyl]thiazolidin-2-ylidene]carbamic acid propargyl ester Formula: C13H12ClN3O2S MolecularWeight: 309.77128

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)N=C1N(CCS1)CC2=CN=C(C=C2)Cl

Isomeric SMILES

C#CCOC(=O)/N=C/1\N(CCS1)CC2=CN=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN3O2S/c1-2-6-19-13(18)16-12-17(5-7-20-12)9-10-3-4-11(14)15-8-10/h1,3-4,8H,5-7,9H2/b16-12+