7-butyl-5-(2-diethylaminoethylsulfanyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-butyl-5-(2-diethylaminoethylsulfanyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-butyl-5-(2-diethylaminoethylsulfanyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-butyl-5-(2-diethylaminoethylthio)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-butyl-5-(2-diethylaminoethylsulfanyl)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-butyl-5-(2-diethylaminoethylthio)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C18H29N5O2S MolecularWeight: 379.52016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)SCCN(CC)CC)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)SCCN(CC)CC)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C18H29N5O2S/c1-6-9-10-13-19-15-14(17(24)22(5)18(25)21(15)4)16(20-13)26-12-11-23(7-2)8-3/h6-12H2,1-5H3