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

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N,N-dipropyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N,N-dipropyl-acetamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]yl)thio]-N,N-dipropylacetamide IUPAC Name: 2-(4-oxo-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N,N-dipropylacetamide Traditional Name: 2-[(3-allyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)thio]-N,N-dipropyl-acetamide Formula: C28H37N3O2S MolecularWeight: 479.67728

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CSC1=NC2=C(C(=O)N1CC=C)C3(CCCCC3)CC4=CC=CC=C42

Isomeric SMILES

CCCN(CCC)C(=O)CSC1=NC2=C(C(=O)N1CC=C)C3(CCCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C28H37N3O2S/c1-4-16-30(17-5-2)23(32)20-34-27-29-25-22-13-9-8-12-21(22)19-28(14-10-7-11-15-28)24(25)26(33)31(27)18-6-3/h6,8-9,12-13H,3-5,7,10-11,14-20H2,1-2H3