1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-8-piperidin-1-yl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-8-piperidin-1-yl-purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-8-(1-piperidyl)purine-2,6-dione CAS Name: 1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]ethyl]-8-(1-piperidinyl)purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-8-piperidin-1-ylpurine-2,6-dione Traditional Name: 1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]ethyl]-8-piperidino-xanthine Formula: C17H23N7O2S2 MolecularWeight: 421.54022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCCN2C3=C(N=C2N4CCCCC4)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=NN=C(S1)SCCN2C3=C(N=C2N4CCCCC4)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C17H23N7O2S2/c1-11-19-20-16(28-11)27-10-9-24-12-13(21(2)17(26)22(3)14(12)25)18-15(24)23-7-5-4-6-8-23/h4-10H2,1-3H3