2-[(4-aminophenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate

Systemtic Name: 2-[(4-aminophenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate Openeye Name: 2-[(4-aminophenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate CAS Name: 2-[(4-aminophenyl)methylthio]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate IUPAC Name: 2-[(4-aminophenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate Traditional Name: 2-[(4-aminobenzyl)thio]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-olate Formula: C14H14N3OS- MolecularWeight: 272.34546

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N=C2[O-])SCC3=CC=C(C=C3)N

Isomeric SMILES

C1CC2=C(C1)N=C(N=C2[O-])SCC3=CC=C(C=C3)N

InChI

InChI=1S/C14H15N3OS/c15-10-6-4-9(5-7-10)8-19-14-16-12-3-1-2-11(12)13(18)17-14/h4-7H,1-3,8,15H2,(H,16,17,18)/p-1