ethyl N-[4-[ethanoyl-(6-methylsulfanylpurin-9-yl)amino]butyl]carbamate

Systemtic Name: ethyl N-[4-[ethanoyl-(6-methylsulfanylpurin-9-yl)amino]butyl]carbamate Openeye Name: ethyl N-[4-[acetyl-(6-methylsulfanylpurin-9-yl)amino]butyl]carbamate CAS Name: N-[4-[acetyl-[6-(methylthio)-9-purinyl]amino]butyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-[acetyl-(6-methylsulfanylpurin-9-yl)amino]butyl]carbamate Traditional Name: N-[4-[acetyl-[6-(methylthio)purin-9-yl]amino]butyl]carbamic acid ethyl ester Formula: C15H22N6O3S MolecularWeight: 366.43858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCCCCN(C(=O)C)N1C=NC2=C1N=CN=C2SC

Isomeric SMILES

CCOC(=O)NCCCCN(C(=O)C)N1C=NC2=C1N=CN=C2SC

InChI

InChI=1S/C15H22N6O3S/c1-4-24-15(23)16-7-5-6-8-20(11(2)22)21-10-19-12-13(21)17-9-18-14(12)25-3/h9-10H,4-8H2,1-3H3,(H,16,23)