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

Systemtic Name: 2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-prop-2-enyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 3-allyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-prop-2-enyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 3-allyl-2-[(2-keto-2-piperidino-ethyl)thio]spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)N5CCCCC5

Isomeric SMILES

C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)N5CCCCC5

InChI

InChI=1S/C26H31N3O2S/c1-2-14-29-24(31)22-23(27-25(29)32-18-21(30)28-15-8-3-9-16-28)20-11-5-4-10-19(20)17-26(22)12-6-7-13-26/h2,4-5,10-11H,1,3,6-9,12-18H2