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

Systemtic Name: N,N-dibutyl-2-(4-oxidanylidene-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-ethanamide Openeye Name: N,N-dibutyl-2-(4-oxo-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-acetamide CAS Name: N,N-dibutyl-2-[(4-oxo-3-phenethyl-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]yl)thio]acetamide IUPAC Name: N,N-dibutyl-2-(4-oxo-3-phenethylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanylacetamide Traditional Name: N,N-dibutyl-2-[(4-keto-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)thio]acetamide Formula: C35H45N3O2S MolecularWeight: 571.8157

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CSC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52

Isomeric SMILES

CCCCN(CCCC)C(=O)CSC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52

InChI

InChI=1S/C35H45N3O2S/c1-3-5-22-37(23-6-4-2)30(39)26-41-34-36-32-29-18-12-11-17-28(29)25-35(20-13-8-14-21-35)31(32)33(40)38(34)24-19-27-15-9-7-10-16-27/h7,9-12,15-18H,3-6,8,13-14,19-26H2,1-2H3