3-butyl-2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one

Systemtic Name: 3-butyl-2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 3-butyl-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 3-butyl-2-[[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]thio]-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 3-butyl-2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 3-butyl-2-[[2-keto-2-(2-ketochromen-3-yl)ethyl]thio]spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C31H30N2O4S MolecularWeight: 526.6459

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)C5=CC6=CC=CC=C6OC5=O

Isomeric SMILES

CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)C5=CC6=CC=CC=C6OC5=O

InChI

InChI=1S/C31H30N2O4S/c1-2-3-16-33-28(35)26-27(22-12-6-4-11-21(22)18-31(26)14-8-9-15-31)32-30(33)38-19-24(34)23-17-20-10-5-7-13-25(20)37-29(23)36/h4-7,10-13,17H,2-3,8-9,14-16,18-19H2,1H3