1-[3-[[5-cyano-6-(3-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-3-(furan-2-ylmethyl)urea

Systemtic Name: 1-[3-[[5-cyano-6-(3-methoxyphenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-3-(furan-2-ylmethyl)urea Openeye Name: 1-[3-[[5-cyano-6-(3-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-3-(2-furylmethyl)urea CAS Name: 1-[3-[[[5-cyano-6-(3-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]thio]methyl]phenyl]-3-(2-furanylmethyl)urea IUPAC Name: 1-[3-[[5-cyano-6-(3-methoxyphenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanylmethyl]phenyl]-3-(furan-2-ylmethyl)urea Traditional Name: 1-[3-[[[5-cyano-4-keto-6-(3-methoxyphenyl)-1H-pyrimidin-2-yl]thio]methyl]phenyl]-3-(2-furfuryl)urea Formula: C25H21N5O4S MolecularWeight: 487.53034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=O)N=C(N2)SCC3=CC(=CC=C3)NC(=O)NCC4=CC=CO4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=O)N=C(N2)SCC3=CC(=CC=C3)NC(=O)NCC4=CC=CO4)C#N

InChI

InChI=1S/C25H21N5O4S/c1-33-19-8-3-6-17(12-19)22-21(13-26)23(31)30-25(29-22)35-15-16-5-2-7-18(11-16)28-24(32)27-14-20-9-4-10-34-20/h2-12H,14-15H2,1H3,(H2,27,28,32)(H,29,30,31)