2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-3-(1-methoxypropan-2-yl)-4-quinazolinone IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-3-(1-methoxypropan-2-yl)quinazolin-4-one Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-3-(2-methoxy-1-methyl-ethyl)quinazolin-4-one Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C(C)COC)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC3=CC=CC=C3C(=O)N2C(C)COC)C)C(C)(C)C

InChI

InChI=1S/C25H32N2O2S/c1-16-12-19(25(4,5)6)13-17(2)21(16)15-30-24-26-22-11-9-8-10-20(22)23(28)27(24)18(3)14-29-7/h8-13,18H,14-15H2,1-7H3