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

Systemtic Name: 2-prop-2-enylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate Openeye Name: 2-allylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate CAS Name: 2-(prop-2-enylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]olate IUPAC Name: 2-prop-2-enylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate Traditional Name: 2-(allylthio)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-olate Formula: C20H21N2OS- MolecularWeight: 337.45854

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C(=N1)[O-])C3(CCCCC3)CC4=CC=CC=C42

Isomeric SMILES

C=CCSC1=NC2=C(C(=N1)[O-])C3(CCCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C20H22N2OS/c1-2-12-24-19-21-17-15-9-5-4-8-14(15)13-20(10-6-3-7-11-20)16(17)18(23)22-19/h2,4-5,8-9H,1,3,6-7,10-13H2,(H,21,22,23)/p-1