2-methylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate

Systemtic Name: 2-methylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate Openeye Name: 2-methylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate CAS Name: 2-(methylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]olate IUPAC Name: 2-methylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate Traditional Name: 2-(methylthio)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate Formula: C18H19N2OS- MolecularWeight: 311.42126

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C(=N1)[O-])C3(CCCCC3)CC4=CC=CC=C42

Isomeric SMILES

CSC1=NC2=C(C(=N1)[O-])C3(CCCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C18H20N2OS/c1-22-17-19-15-13-8-4-3-7-12(13)11-18(9-5-2-6-10-18)14(15)16(21)20-17/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,19,20,21)/p-1