2-[(4-chlorophenyl)methylsulfanyl]-3-ethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-ethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-ethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-3-ethyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-ethylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-3-ethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C25H25ClN2OS MolecularWeight: 436.9968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC5=CC=C(C=C5)Cl

Isomeric SMILES

CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H25ClN2OS/c1-2-28-23(29)21-22(27-24(28)30-16-17-9-11-19(26)12-10-17)20-8-4-3-7-18(20)15-25(21)13-5-6-14-25/h3-4,7-12H,2,5-6,13-16H2,1H3