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

Systemtic Name: (E)-4-(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanyl-N-methyl-N-phenyl-but-2-enamide Openeye Name: (E)-4-(4-amino-6-chloro-pyrimidin-2-yl)sulfanyl-N-methyl-N-phenyl-but-2-enamide CAS Name: (E)-4-[(4-amino-6-chloro-2-pyrimidinyl)thio]-N-methyl-N-phenyl-2-butenamide IUPAC Name: (E)-4-(4-amino-6-chloropyrimidin-2-yl)sulfanyl-N-methyl-N-phenylbut-2-enamide Traditional Name: (E)-4-[(4-amino-6-chloro-pyrimidin-2-yl)thio]-N-methyl-N-phenyl-but-2-enamide Formula: C15H15ClN4OS MolecularWeight: 334.8238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)C=CCSC2=NC(=CC(=N2)Cl)N

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)/C=C/CSC2=NC(=CC(=N2)Cl)N

InChI

InChI=1S/C15H15ClN4OS/c1-20(11-6-3-2-4-7-11)14(21)8-5-9-22-15-18-12(16)10-13(17)19-15/h2-8,10H,9H2,1H3,(H2,17,18,19)/b8-5+