(5R)-2-butylsulfanyl-5-ethyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one

Systemtic Name: (5R)-2-butylsulfanyl-5-ethyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one Openeye Name: (5R)-2-butylsulfanyl-5-ethyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one CAS Name: (5R)-2-(butylthio)-5-ethyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one IUPAC Name: (5R)-2-butylsulfanyl-5-ethyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one Traditional Name: (5R)-2-(butylthio)-5-ethyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one Formula: C25H28N2OS MolecularWeight: 404.56762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3)C(CC4=CC=CC=C42)(C)CC

Isomeric SMILES

CCCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3)[C@](CC4=CC=CC=C42)(C)CC

InChI

InChI=1S/C25H28N2OS/c1-4-6-16-29-24-26-22-20-15-11-10-12-18(20)17-25(3,5-2)21(22)23(28)27(24)19-13-8-7-9-14-19/h7-15H,4-6,16-17H2,1-3H3/t25-/m1/s1