ethyl 1-[5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]furan-2-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]furan-2-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]furan-2-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[5-[[[4-(diethylamino)-6-ethyl-2-pyrimidinyl]thio]methyl]-2-furanyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-[[4-(diethylamino)-6-ethylpyrimidin-2-yl]sulfanylmethyl]furan-2-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[5-[[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]thio]methyl]-2-furoyl]nipecotic acid ethyl ester Formula: C24H34N4O4S MolecularWeight: 474.61616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)N3CCCC(C3)C(=O)OCC)N(CC)CC

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)N3CCCC(C3)C(=O)OCC)N(CC)CC

InChI

InChI=1S/C24H34N4O4S/c1-5-18-14-21(27(6-2)7-3)26-24(25-18)33-16-19-11-12-20(32-19)22(29)28-13-9-10-17(15-28)23(30)31-8-4/h11-12,14,17H,5-10,13,15-16H2,1-4H3