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

Systemtic Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-thiolate Openeye Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-thiolate CAS Name: 2-phenyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]thiolate IUPAC Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-thiolate Traditional Name: 2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-thiolate Formula: C22H19N2S- MolecularWeight: 343.46466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=NC(=N4)C5=CC=CC=C5)[S-]

Isomeric SMILES

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=NC(=N4)C5=CC=CC=C5)[S-]

InChI

InChI=1S/C22H20N2S/c25-21-18-19(23-20(24-21)15-8-2-1-3-9-15)17-11-5-4-10-16(17)14-22(18)12-6-7-13-22/h1-5,8-11H,6-7,12-14H2,(H,23,24,25)/p-1