(E)-4-(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanyl-N-methyl-N-prop-2-enyl-but-2-enamide

Systemtic Name: (E)-4-(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanyl-N-methyl-N-prop-2-enyl-but-2-enamide Openeye Name: (E)-N-allyl-4-(4-amino-6-chloro-pyrimidin-2-yl)sulfanyl-N-methyl-but-2-enamide CAS Name: (E)-4-[(4-amino-6-chloro-2-pyrimidinyl)thio]-N-methyl-N-prop-2-enyl-2-butenamide IUPAC Name: (E)-4-(4-amino-6-chloropyrimidin-2-yl)sulfanyl-N-methyl-N-prop-2-enylbut-2-enamide Traditional Name: (E)-N-allyl-4-[(4-amino-6-chloro-pyrimidin-2-yl)thio]-N-methyl-but-2-enamide Formula: C12H15ClN4OS MolecularWeight: 298.7917

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC=C)C(=O)C=CCSC1=NC(=CC(=N1)Cl)N

Isomeric SMILES

CN(CC=C)C(=O)/C=C/CSC1=NC(=CC(=N1)Cl)N

InChI

InChI=1S/C12H15ClN4OS/c1-3-6-17(2)11(18)5-4-7-19-12-15-9(13)8-10(14)16-12/h3-5,8H,1,6-7H2,2H3,(H2,14,15,16)/b5-4+