7-cyclohexyl-1-(2-methylpropyl)-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-cyclohexyl-1-(2-methylpropyl)-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-cyclohexyl-1-isobutyl-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-cyclohexyl-1-(2-methylpropyl)-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-cyclohexyl-1-(2-methylpropyl)-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-cyclohexyl-1-isobutyl-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=O)NC1=O)C(=S)N=C(N2)C3CCCCC3

Isomeric SMILES

CC(C)CN1C2=C(C(=O)NC1=O)C(=S)N=C(N2)C3CCCCC3

InChI

InChI=1S/C16H22N4O2S/c1-9(2)8-20-13-11(14(21)19-16(20)22)15(23)18-12(17-13)10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H,17,18,23)(H,19,21,22)