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

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N,N-dipropyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N,N-dipropyl-acetamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]yl)thio]-N,N-dipropylacetamide IUPAC Name: 2-(4-oxo-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N,N-dipropylacetamide Traditional Name: 2-[(3-allyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)thio]-N,N-dipropyl-acetamide Formula: C27H35N3O2S MolecularWeight: 465.6507

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CSC1=NC2=C(C(=O)N1CC=C)C3(CCCC3)CC4=CC=CC=C42

Isomeric SMILES

CCCN(CCC)C(=O)CSC1=NC2=C(C(=O)N1CC=C)C3(CCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C27H35N3O2S/c1-4-15-29(16-5-2)22(31)19-33-26-28-24-21-12-8-7-11-20(21)18-27(13-9-10-14-27)23(24)25(32)30(26)17-6-3/h6-8,11-12H,3-5,9-10,13-19H2,1-2H3