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

Systemtic Name: ethyl 2-[3-(2-methylpropyl)-4-oxidanylidene-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanylethanoate Openeye Name: ethyl 2-(3-isobutyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanylacetate CAS Name: 2-[[3-(2-methylpropyl)-4-oxo-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(2-methylpropyl)-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanylacetate Traditional Name: 2-[(3-isobutyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)thio]acetic acid ethyl ester Formula: C24H30N2O3S MolecularWeight: 426.5716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C(=O)N1CC(C)C)C3(CCCC3)CC4=CC=CC=C42

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C(=O)N1CC(C)C)C3(CCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C24H30N2O3S/c1-4-29-19(27)15-30-23-25-21-18-10-6-5-9-17(18)13-24(11-7-8-12-24)20(21)22(28)26(23)14-16(2)3/h5-6,9-10,16H,4,7-8,11-15H2,1-3H3