2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-methyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-methyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-3-methyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one CAS Name: 2-[[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]-3-methyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-3-methyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 2-[[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]thio]-3-methyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)N=C1SCC(=O)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CN1C(=O)C2=C(C(=CN2)C3=CC=CC=C3)N=C1SCC(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C26H27N5O3S/c1-29-25(33)24-23(19(16-27-24)18-8-4-3-5-9-18)28-26(29)35-17-22(32)31-14-12-30(13-15-31)20-10-6-7-11-21(20)34-2/h3-11,16,27H,12-15,17H2,1-2H3