butyl 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[2-[(3-methoxyphenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-keto-2-(m-anisylthio)-1H-pyrimidin-6-yl]acetyl]amino]benzoic acid butyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C25H27N3O5S/c1-3-4-12-33-24(31)18-8-10-19(11-9-18)26-22(29)14-20-15-23(30)28-25(27-20)34-16-17-6-5-7-21(13-17)32-2/h5-11,13,15H,3-4,12,14,16H2,1-2H3,(H,26,29)(H,27,28,30)