N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)ethanamide

Systemtic Name: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)ethanamide Openeye Name: N-[4-(4-ethoxyphenyl)thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)acetamide CAS Name: N-[4-(4-ethoxyphenyl)-2-thiazolyl]-2-(7H-purin-6-ylthio)acetamide IUPAC Name: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-(7H-purin-6-ylsulfanyl)acetamide Traditional Name: N-(4-p-phenetylthiazol-2-yl)-2-(7H-purin-6-ylthio)acetamide Formula: C18H16N6O2S2 MolecularWeight: 412.48864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C18H16N6O2S2/c1-2-26-12-5-3-11(4-6-12)13-7-28-18(23-13)24-14(25)8-27-17-15-16(20-9-19-15)21-10-22-17/h3-7,9-10H,2,8H2,1H3,(H,23,24,25)(H,19,20,21,22)