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

Systemtic Name: (E)-4-(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanyl-N-ethyl-N-methyl-but-2-enamide Openeye Name: (E)-4-(4-amino-6-chloro-pyrimidin-2-yl)sulfanyl-N-ethyl-N-methyl-but-2-enamide CAS Name: (E)-4-[(4-amino-6-chloro-2-pyrimidinyl)thio]-N-ethyl-N-methyl-2-butenamide IUPAC Name: (E)-4-(4-amino-6-chloropyrimidin-2-yl)sulfanyl-N-ethyl-N-methylbut-2-enamide Traditional Name: (E)-4-[(4-amino-6-chloro-pyrimidin-2-yl)thio]-N-ethyl-N-methyl-but-2-enamide Formula: C11H15ClN4OS MolecularWeight: 286.781

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15ClN4OS/c1-3-16(2)10(17)5-4-6-18-11-14-8(12)7-9(13)15-11/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15)/b5-4+