6-[(5-nitrofuran-2-yl)methyl]-2-sulfanylidene-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 6-[(5-nitrofuran-2-yl)methyl]-2-sulfanylidene-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Openeye Name: 6-[(5-nitro-2-furyl)methyl]-2-thioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one CAS Name: 6-[(5-nitro-2-furanyl)methyl]-2-sulfanylidene-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one IUPAC Name: 6-[(5-nitrofuran-2-yl)methyl]-2-sulfanylidene-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Traditional Name: 6-[(5-nitro-2-furyl)methyl]-2-thioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1NC(=S)NC2=O)CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=C1NC(=S)NC2=O)CC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4S/c17-11-8-6-15(4-3-9(8)13-12(21)14-11)5-7-1-2-10(20-7)16(18)19/h1-2H,3-6H2,(H2,13,14,17,21)