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

Systemtic Name: 2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-3-prop-2-enyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 3-allyl-2-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 2-[(2-oxo-2-thiophen-2-ylethyl)thio]-3-prop-2-enyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 2-(2-oxo-2-thiophen-2-ylethyl)sulfanyl-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 3-allyl-2-[[2-keto-2-(2-thienyl)ethyl]thio]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C26H26N2O2S2 MolecularWeight: 462.62684

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CS5

Isomeric SMILES

C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CS5

InChI

InChI=1S/C26H26N2O2S2/c1-2-14-28-24(30)22-23(27-25(28)32-17-20(29)21-11-8-15-31-21)19-10-5-4-9-18(19)16-26(22)12-6-3-7-13-26/h2,4-5,8-11,15H,1,3,6-7,12-14,16-17H2