1-(6-azanyl-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl)ethanone

Systemtic Name: 1-(6-azanyl-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl)ethanone Openeye Name: 1-(6-amino-2-phenyl-4-thioxo-1H-pyrimidin-5-yl)ethanone CAS Name: 1-(6-amino-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl)ethanone IUPAC Name: 1-(6-amino-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl)ethanone Traditional Name: 1-(6-amino-2-phenyl-4-thioxo-1H-pyrimidin-5-yl)ethanone Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)N

Isomeric SMILES

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)N

InChI

InChI=1S/C12H11N3OS/c1-7(16)9-10(13)14-11(15-12(9)17)8-5-3-2-4-6-8/h2-6H,1H3,(H3,13,14,15,17)