ethyl 2-[5-[[1-[2-[dodecyl(methyl)amino]-2-oxidanylidene-ethyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-pyrimidin-5-yl]methyl]-2-oxidanylidene-pyrimidin-1-yl]ethanoate

Systemtic Name: ethyl 2-[5-[[1-[2-[dodecyl(methyl)amino]-2-oxidanylidene-ethyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-pyrimidin-5-yl]methyl]-2-oxidanylidene-pyrimidin-1-yl]ethanoate Openeye Name: ethyl 2-[5-[[1-[2-[dodecyl(methyl)amino]-2-oxo-ethyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-pyrimidin-5-yl]methyl]-2-oxo-pyrimidin-1-yl]acetate CAS Name: 2-[5-[[1-[2-[dodecyl(methyl)amino]-2-oxoethyl]-2-[(4-fluorophenyl)methylthio]-4-oxo-5-pyrimidinyl]methyl]-2-oxo-1-pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[[1-[2-[dodecyl(methyl)amino]-2-oxoethyl]-2-[(4-fluorophenyl)methylsulfanyl]-4-oxopyrimidin-5-yl]methyl]-2-oxopyrimidin-1-yl]acetate Traditional Name: 2-[5-[[2-[(4-fluorobenzyl)thio]-4-keto-1-[2-keto-2-[lauryl(methyl)amino]ethyl]pyrimidin-5-yl]methyl]-2-keto-pyrimidin-1-yl]acetic acid ethyl ester Formula: C35H48FN5O5S MolecularWeight: 669.849523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C)C(=O)CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN(C(=O)N=C3)CC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCN(C)C(=O)CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN(C(=O)N=C3)CC(=O)OCC

InChI

InChI=1S/C35H48FN5O5S/c1-4-6-7-8-9-10-11-12-13-14-19-39(3)31(42)24-41-23-29(20-28-21-37-34(45)40(22-28)25-32(43)46-5-2)33(44)38-35(41)47-26-27-15-17-30(36)18-16-27/h15-18,21-23H,4-14,19-20,24-26H2,1-3H3