2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-thiolate

Systemtic Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-thiolate Openeye Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-thiolate CAS Name: 2-phenyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]thiolate IUPAC Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-thiolate Traditional Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-thiolate Formula: C23H21N2S- MolecularWeight: 357.49124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=NC(=N4)C5=CC=CC=C5)[S-]

Isomeric SMILES

C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=NC(=N4)C5=CC=CC=C5)[S-]

InChI

InChI=1S/C23H22N2S/c26-22-19-20(24-21(25-22)16-9-3-1-4-10-16)18-12-6-5-11-17(18)15-23(19)13-7-2-8-14-23/h1,3-6,9-12H,2,7-8,13-15H2,(H,24,25,26)/p-1