3-[(4-methoxyphenyl)methyl]-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[(4-methoxyphenyl)methyl]-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[(4-methoxyphenyl)methyl]-2-[[4-(1-pyrazolyl)phenyl]methylthio]-4-quinazolinone IUPAC Name: 3-[(4-methoxyphenyl)methyl]-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-p-anisyl-2-[(4-pyrazol-1-ylbenzyl)thio]quinazolin-4-one Formula: C26H22N4O2S MolecularWeight: 454.54348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C26H22N4O2S/c1-32-22-13-9-19(10-14-22)17-29-25(31)23-5-2-3-6-24(23)28-26(29)33-18-20-7-11-21(12-8-20)30-16-4-15-27-30/h2-16H,17-18H2,1H3