3-(furan-2-ylmethyl)-2-methylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-2-methylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 3-(2-furylmethyl)-2-methylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 3-(2-furanylmethyl)-2-(methylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 3-(furan-2-ylmethyl)-2-methylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 3-(2-furfuryl)-2-(methylthio)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCC4)CC5=CC=CC=C52

Isomeric SMILES

CSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCC4)CC5=CC=CC=C52

InChI

InChI=1S/C22H22N2O2S/c1-27-21-23-19-17-9-3-2-7-15(17)13-22(10-4-5-11-22)18(19)20(25)24(21)14-16-8-6-12-26-16/h2-3,6-9,12H,4-5,10-11,13-14H2,1H3