N-(phenylmethyl)-3-pyrimidin-2-ylsulfanyl-propan-1-amine

Systemtic Name: N-(phenylmethyl)-3-pyrimidin-2-ylsulfanyl-propan-1-amine Openeye Name: N-benzyl-3-pyrimidin-2-ylsulfanyl-propan-1-amine CAS Name: N-(phenylmethyl)-3-(2-pyrimidinylthio)-1-propanamine IUPAC Name: N-benzyl-3-pyrimidin-2-ylsulfanylpropan-1-amine Traditional Name: benzyl-[3-(2-pyrimidylthio)propyl]amine Formula: C14H17N3S MolecularWeight: 259.36988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCSC2=NC=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)CNCCCSC2=NC=CC=N2

InChI

InChI=1S/C14H17N3S/c1-2-6-13(7-3-1)12-15-8-5-11-18-14-16-9-4-10-17-14/h1-4,6-7,9-10,15H,5,8,11-12H2