ethyl (4-oxidanylidenespiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-2-yl)methylsulfanylmethanoate

Systemtic Name: ethyl (4-oxidanylidenespiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-2-yl)methylsulfanylmethanoate Openeye Name: ethyl (4-oxospiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-2-yl)methylsulfanylformate CAS Name: [(4-oxo-2-spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]yl)methylthio]formic acid ethyl ester IUPAC Name: ethyl (4-oxospiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-2-yl)methylsulfanylformate Traditional Name: [(4-ketospiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-2-yl)methylthio]formic acid ethyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)SCC1=NC(=O)C2=C(N1)C3=CC=CC=C3CC24CCCC4

Isomeric SMILES

CCOC(=O)SCC1=NC(=O)C2=C(N1)C3=CC=CC=C3CC24CCCC4

InChI

InChI=1S/C20H22N2O3S/c1-2-25-19(24)26-12-15-21-17-14-8-4-3-7-13(14)11-20(9-5-6-10-20)16(17)18(23)22-15/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,21,22,23)