3-butyl-2-ethyl-thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-butyl-2-ethyl-thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-butyl-2-ethyl-thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-butyl-2-ethylthiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-butyl-2-ethylthiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-butyl-2-ethyl-thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)CC

Isomeric SMILES

CCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)CC

InChI

InChI=1S/C17H18N2O2S/c1-3-5-10-19-13(4-2)18-16-14(17(19)21)15(20)11-8-6-7-9-12(11)22-16/h6-9H,3-5,10H2,1-2H3