ethyl 2-[[5-[(6-methyl-2-pyrrolidin-1-yl-pyrimidin-4-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-[(6-methyl-2-pyrrolidin-1-yl-pyrimidin-4-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-[(6-methyl-2-pyrrolidin-1-yl-pyrimidin-4-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[[6-methyl-2-(1-pyrrolidinyl)-4-pyrimidinyl]thio]methyl]-1,3,4-oxadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)sulfanylmethyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[[(6-methyl-2-pyrrolidino-pyrimidin-4-yl)thio]methyl]-1,3,4-oxadiazol-2-yl]thio]acetic acid ethyl ester Formula: C16H21N5O3S2 MolecularWeight: 395.49964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(O1)CSC2=NC(=NC(=C2)C)N3CCCC3

Isomeric SMILES

CCOC(=O)CSC1=NN=C(O1)CSC2=NC(=NC(=C2)C)N3CCCC3

InChI

InChI=1S/C16H21N5O3S2/c1-3-23-14(22)10-26-16-20-19-12(24-16)9-25-13-8-11(2)17-15(18-13)21-6-4-5-7-21/h8H,3-7,9-10H2,1-2H3