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

Systemtic Name: 1-phenethyl-2-(phenylsulfanylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 1-phenethyl-2-(phenylsulfanylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 1-phenethyl-2-[(phenylthio)methyl]-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 1-phenethyl-2-(phenylsulfanylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 1-phenethyl-2-[(phenylthio)methyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C31H30N2OS MolecularWeight: 478.6477

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N=C(N4CCC5=CC=CC=C5)CSC6=CC=CC=C6

Isomeric SMILES

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N=C(N4CCC5=CC=CC=C5)CSC6=CC=CC=C6

InChI

InChI=1S/C31H30N2OS/c34-30-28-29(26-16-8-7-13-24(26)21-31(28)18-9-10-19-31)33(20-17-23-11-3-1-4-12-23)27(32-30)22-35-25-14-5-2-6-15-25/h1-8,11-16H,9-10,17-22H2