2-azanyl-6-methyl-5-pyridin-4-ylsulfanyl-3,4a,7,7a-tetrahydropyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-6-methyl-5-pyridin-4-ylsulfanyl-3,4a,7,7a-tetrahydropyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-6-methyl-5-(4-pyridylsulfanyl)-3,4a,7,7a-tetrahydropyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-6-methyl-5-(pyridin-4-ylthio)-3,4a,7,7a-tetrahydropyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-amino-6-methyl-5-pyridin-4-ylsulfanyl-3,4a,7,7a-tetrahydropyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-6-methyl-5-(4-pyridylthio)-3,4a,7,7a-tetrahydropyrrolo[2,3-d]pyrimidin-4-one Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2C(N1)N=C(NC2=O)N)SC3=CC=NC=C3

Isomeric SMILES

CC1=C(C2C(N1)N=C(NC2=O)N)SC3=CC=NC=C3

InChI

InChI=1S/C12H13N5OS/c1-6-9(19-7-2-4-14-5-3-7)8-10(15-6)16-12(13)17-11(8)18/h2-5,8,10,15H,1H3,(H3,13,16,17,18)