2-[1-(4-ethylphenyl)-1-oxidanylidene-butan-2-yl]sulfanyl-1H-quinazolin-4-one

Systemtic Name: 2-[1-(4-ethylphenyl)-1-oxidanylidene-butan-2-yl]sulfanyl-1H-quinazolin-4-one Openeye Name: 2-[1-(4-ethylbenzoyl)propylsulfanyl]-1H-quinazolin-4-one CAS Name: 2-[[1-(4-ethylphenyl)-1-oxobutan-2-yl]thio]-1H-quinazolin-4-one IUPAC Name: 2-[1-(4-ethylphenyl)-1-oxobutan-2-yl]sulfanyl-1H-quinazolin-4-one Traditional Name: 2-[1-(4-ethylbenzoyl)propylthio]-1H-quinazolin-4-one Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(CC)SC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(CC)SC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H20N2O2S/c1-3-13-9-11-14(12-10-13)18(23)17(4-2)25-20-21-16-8-6-5-7-15(16)19(24)22-20/h5-12,17H,3-4H2,1-2H3,(H,21,22,24)