6-chloranyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-pyrimidin-4-amine

Systemtic Name: 6-chloranyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-pyrimidin-4-amine Openeye Name: 6-chloro-2-[(E)-cinnamyl]sulfanyl-pyrimidin-4-amine CAS Name: 6-chloro-2-[[(E)-3-phenylprop-2-enyl]thio]-4-pyrimidinamine IUPAC Name: 6-chloro-2-[(E)-3-phenylprop-2-enyl]sulfanylpyrimidin-4-amine Traditional Name: [6-chloro-2-[[(E)-cinnamyl]thio]pyrimidin-4-yl]amine Formula: C13H12ClN3S MolecularWeight: 277.77248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12ClN3S/c14-11-9-12(15)17-13(16-11)18-8-4-7-10-5-2-1-3-6-10/h1-7,9H,8H2,(H2,15,16,17)/b7-4+