2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-pyrimidin-2-yl-ethanamide

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-pyrimidin-2-yl-ethanamide Openeye Name: 2-(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanyl-N-pyrimidin-2-yl-acetamide CAS Name: 2-[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]-N-(2-pyrimidinyl)acetamide IUPAC Name: 2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-pyrimidin-2-ylacetamide Traditional Name: 2-[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]-N-(2-pyrimidyl)acetamide Formula: C13H14N6O2S MolecularWeight: 318.35426

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CC(=O)N=C1SCC(=O)NC2=NC=CC=N2)N

Isomeric SMILES

C=CCN1C(=CC(=O)N=C1SCC(=O)NC2=NC=CC=N2)N

InChI

InChI=1S/C13H14N6O2S/c1-2-6-19-9(14)7-10(20)18-13(19)22-8-11(21)17-12-15-4-3-5-16-12/h2-5,7H,1,6,8,14H2,(H,15,16,17,21)