1-(furan-2-ylmethyl)-4-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one

Systemtic Name: 1-(furan-2-ylmethyl)-4-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Openeye Name: 1-(2-furylmethyl)-4-[2-(3-nitrophenyl)-2-oxo-ethyl]sulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one CAS Name: 1-(2-furanylmethyl)-4-[[2-(3-nitrophenyl)-2-oxoethyl]thio]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one IUPAC Name: 1-(furan-2-ylmethyl)-4-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Traditional Name: 1-(2-furfuryl)-4-[[2-keto-2-(3-nitrophenyl)ethyl]thio]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N(C(=O)N=C2SCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CO4

Isomeric SMILES

C1CC2=C(C1)N(C(=O)N=C2SCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CO4

InChI

InChI=1S/C20H17N3O5S/c24-18(13-4-1-5-14(10-13)23(26)27)12-29-19-16-7-2-8-17(16)22(20(25)21-19)11-15-6-3-9-28-15/h1,3-6,9-10H,2,7-8,11-12H2