2-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-3-ethyl-quinazolin-4-one

Systemtic Name: 2-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-3-ethyl-quinazolin-4-one Openeye Name: 2-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-3-ethyl-quinazolin-4-one CAS Name: 2-[(1,3-diphenyl-4-pyrazolyl)methylthio]-3-ethyl-4-quinazolinone IUPAC Name: 2-[(1,3-diphenylpyrazol-4-yl)methylsulfanyl]-3-ethylquinazolin-4-one Traditional Name: 2-[(1,3-diphenylpyrazol-4-yl)methylthio]-3-ethyl-quinazolin-4-one Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4OS/c1-2-29-25(31)22-15-9-10-16-23(22)27-26(29)32-18-20-17-30(21-13-7-4-8-14-21)28-24(20)19-11-5-3-6-12-19/h3-17H,2,18H2,1H3