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

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-(3-ethyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[(3-ethyl-4-oxo-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]yl)thio]-N-phenethylacetamide IUPAC Name: 2-(3-ethyl-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N-phenethylacetamide Traditional Name: 2-[(3-ethyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)thio]-N-phenethyl-acetamide Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)NCCC5=CC=CC=C5

Isomeric SMILES

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C28H31N3O2S/c1-2-31-26(33)24-25(22-13-7-6-12-21(22)18-28(24)15-8-9-16-28)30-27(31)34-19-23(32)29-17-14-20-10-4-3-5-11-20/h3-7,10-13H,2,8-9,14-19H2,1H3,(H,29,32)