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

Systemtic Name: 3-butyl-2-propan-2-yl-thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-butyl-2-isopropyl-thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-butyl-2-propan-2-ylthiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-butyl-2-propan-2-ylthiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-butyl-2-isopropyl-thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1C(C)C)SC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1C(C)C)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C18H20N2O2S/c1-4-5-10-20-16(11(2)3)19-17-14(18(20)22)15(21)12-8-6-7-9-13(12)23-17/h6-9,11H,4-5,10H2,1-3H3