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

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-(3-ethyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: 2-[(3-ethyl-4-oxo-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]yl)thio]-N-phenylacetamide IUPAC Name: 2-(3-ethyl-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(3-ethyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)thio]-N-phenyl-acetamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=CC=C5

Isomeric SMILES

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H29N3O2S/c1-2-30-25(32)23-24(29-26(30)33-18-22(31)28-20-12-5-3-6-13-20)21-14-8-7-11-19(21)17-27(23)15-9-4-10-16-27/h3,5-8,11-14H,2,4,9-10,15-18H2,1H3,(H,28,31)