2-[(4-tert-butylphenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-(1-methoxypropan-2-yl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H28N2O2S/c1-16(14-27-5)25-21(26)19-8-6-7-9-20(19)24-22(25)28-15-17-10-12-18(13-11-17)23(2,3)4/h6-13,16H,14-15H2,1-5H3