3-methyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 3-methyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-isopropyl-3-methyl-5-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 3-methyl-5-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 3-methyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-isopropyl-5-[(2-keto-2-piperidino-ethyl)thio]-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C20H29N5O3S MolecularWeight: 419.54096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C(C)C)SCC(=O)N3CCCCC3)C(=O)N(C1=O)C

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C(C)C)SCC(=O)N3CCCCC3)C(=O)N(C1=O)C

InChI

InChI=1S/C20H29N5O3S/c1-5-9-25-17-15(19(27)23(4)20(25)28)18(22-16(21-17)13(2)3)29-12-14(26)24-10-7-6-8-11-24/h13H,5-12H2,1-4H3