6-phenylsulfanyl-N5-prop-2-enyl-pyrimidine-4,5-diamine

Systemtic Name: 6-phenylsulfanyl-N5-prop-2-enyl-pyrimidine-4,5-diamine Openeye Name: N5-allyl-6-phenylsulfanyl-pyrimidine-4,5-diamine CAS Name: 6-(phenylthio)-N5-prop-2-enylpyrimidine-4,5-diamine IUPAC Name: 6-phenylsulfanyl-5-N-prop-2-enylpyrimidine-4,5-diamine Traditional Name: allyl-[4-amino-6-(phenylthio)pyrimidin-5-yl]amine Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=C(N=CN=C1SC2=CC=CC=C2)N

Isomeric SMILES

C=CCNC1=C(N=CN=C1SC2=CC=CC=C2)N

InChI

InChI=1S/C13H14N4S/c1-2-8-15-11-12(14)16-9-17-13(11)18-10-6-4-3-5-7-10/h2-7,9,15H,1,8H2,(H2,14,16,17)