N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-phenylmethoxy-5-(1,3-thiazol-2-ylmethyl)pyrimidin-2-amine

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-phenylmethoxy-5-(1,3-thiazol-2-ylmethyl)pyrimidin-2-amine Openeye Name: 4-benzyloxy-N-[2-(2-furylmethylsulfanyl)ethyl]-5-(thiazol-2-ylmethyl)pyrimidin-2-amine CAS Name: N-[2-(2-furanylmethylthio)ethyl]-4-phenylmethoxy-5-(2-thiazolylmethyl)-2-pyrimidinamine IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-phenylmethoxy-5-(1,3-thiazol-2-ylmethyl)pyrimidin-2-amine Traditional Name: [4-benzoxy-5-(thiazol-2-ylmethyl)pyrimidin-2-yl]-[2-(2-furfurylthio)ethyl]amine Formula: C22H22N4O2S2 MolecularWeight: 438.56568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC(=NC=C2CC3=NC=CS3)NCCSCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC(=NC=C2CC3=NC=CS3)NCCSCC4=CC=CO4

InChI

InChI=1S/C22H22N4O2S2/c1-2-5-17(6-3-1)15-28-21-18(13-20-23-9-12-30-20)14-25-22(26-21)24-8-11-29-16-19-7-4-10-27-19/h1-7,9-10,12,14H,8,11,13,15-16H2,(H,24,25,26)