6-chloranyl-7-nitro-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-7-nitro-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-1H-quinazolin-4-one Openeye Name: 6-chloro-7-nitro-2-thioxo-4a,5,6,7,8,8a-hexahydro-1H-quinazolin-4-one CAS Name: 6-chloro-7-nitro-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-1H-quinazolin-4-one IUPAC Name: 6-chloro-7-nitro-2-sulfanylidene-4a,5,6,7,8,8a-hexahydro-1H-quinazolin-4-one Traditional Name: 6-chloro-7-nitro-2-thioxo-4a,5,6,7,8,8a-hexahydro-1H-quinazolin-4-one Formula: C8H10ClN3O3S MolecularWeight: 263.7013

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(CC(C1Cl)[N+](=O)[O-])NC(=S)NC2=O

Isomeric SMILES

C1C2C(CC(C1Cl)[N+](=O)[O-])NC(=S)NC2=O

InChI

InChI=1S/C8H10ClN3O3S/c9-4-1-3-5(2-6(4)12(14)15)10-8(16)11-7(3)13/h3-6H,1-2H2,(H2,10,11,13,16)