ethyl 4-[2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanylethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[6-(2,6-dimethyl-4-morpholinyl)-4-pyrimidinyl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[6-(2,6-dimethylmorpholin-4-yl)pyrimidin-4-yl]sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[6-(2,6-dimethylmorpholino)pyrimidin-4-yl]thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H29N5O4S MolecularWeight: 423.52966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC=NC(=C2)N3CC(OC(C3)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC=NC(=C2)N3CC(OC(C3)C)C

InChI

InChI=1S/C19H29N5O4S/c1-4-27-19(26)23-7-5-22(6-8-23)18(25)12-29-17-9-16(20-13-21-17)24-10-14(2)28-15(3)11-24/h9,13-15H,4-8,10-12H2,1-3H3