(6E)-6-(5-azanyl-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(5-azanyl-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-(5-amino-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[5-amino-6-methyl-2-(methylthio)-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(5-amino-6-methyl-2-methylsulfanyl-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[5-amino-6-methyl-2-(methylthio)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC=CC2=O)N=C(N1)SC)N

Isomeric SMILES

CC1=C(/C(=C\2/C=CC=CC2=O)/N=C(N1)SC)N

InChI

InChI=1S/C12H13N3OS/c1-7-10(13)11(15-12(14-7)17-2)8-5-3-4-6-9(8)16/h3-6H,13H2,1-2H3,(H,14,15)/b11-8+