ethyl (4-oxidanylidene-3-phenethyl-spiro[5H-benzo[h]quinazoline-6,1'-cyclopentane]-2-yl)methylsulfanylmethanoate

Systemtic Name: ethyl (4-oxidanylidene-3-phenethyl-spiro[5H-benzo[h]quinazoline-6,1'-cyclopentane]-2-yl)methylsulfanylmethanoate Openeye Name: ethyl (4-oxo-3-phenethyl-spiro[5H-benzo[h]quinazoline-6,1'-cyclopentane]-2-yl)methylsulfanylformate CAS Name: [(4-oxo-3-phenethyl-2-spiro[5H-benzo[h]quinazoline-6,1'-cyclopentane]yl)methylthio]formic acid ethyl ester IUPAC Name: ethyl (4-oxo-3-phenethylspiro[5H-benzo[h]quinazoline-6,1'-cyclopentane]-2-yl)methylsulfanylformate Traditional Name: [(4-keto-3-phenethyl-spiro[5H-benzo[h]quinazoline-6,1'-cyclopentane]-2-yl)methylthio]formic acid ethyl ester Formula: C28H30N2O3S MolecularWeight: 474.6144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)SCC1=NC2=C(CC3(CCCC3)C4=CC=CC=C42)C(=O)N1CCC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)SCC1=NC2=C(CC3(CCCC3)C4=CC=CC=C42)C(=O)N1CCC5=CC=CC=C5

InChI

InChI=1S/C28H30N2O3S/c1-2-33-27(32)34-19-24-29-25-21-12-6-7-13-23(21)28(15-8-9-16-28)18-22(25)26(31)30(24)17-14-20-10-4-3-5-11-20/h3-7,10-13H,2,8-9,14-19H2,1H3