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

Systemtic Name: 2-[(2,4-dichlorophenyl)methylsulfanyl]-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 2-[(2,4-dichlorophenyl)methylsulfanyl]-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 2-[(2,4-dichlorophenyl)methylthio]-3-phenethyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 2-[(2,4-dichlorophenyl)methylsulfanyl]-3-phenethylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 2-[(2,4-dichlorobenzyl)thio]-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C31H28Cl2N2OS MolecularWeight: 547.53782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC5=C(C=C(C=C5)Cl)Cl)CCC6=CC=CC=C6

Isomeric SMILES

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC5=C(C=C(C=C5)Cl)Cl)CCC6=CC=CC=C6

InChI

InChI=1S/C31H28Cl2N2OS/c32-24-13-12-23(26(33)18-24)20-37-30-34-28-25-11-5-4-10-22(25)19-31(15-6-7-16-31)27(28)29(36)35(30)17-14-21-8-2-1-3-9-21/h1-5,8-13,18H,6-7,14-17,19-20H2