2-quinazolin-4-ylsulfanyl-1-(2,4,5-trimethylphenyl)ethanone

Systemtic Name: 2-quinazolin-4-ylsulfanyl-1-(2,4,5-trimethylphenyl)ethanone Openeye Name: 2-quinazolin-4-ylsulfanyl-1-(2,4,5-trimethylphenyl)ethanone CAS Name: 2-(4-quinazolinylthio)-1-(2,4,5-trimethylphenyl)ethanone IUPAC Name: 2-quinazolin-4-ylsulfanyl-1-(2,4,5-trimethylphenyl)ethanone Traditional Name: 2-(quinazolin-4-ylthio)-1-(2,4,5-trimethylphenyl)ethanone Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=NC=NC3=CC=CC=C32)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=NC=NC3=CC=CC=C32)C)C

InChI

InChI=1S/C19H18N2OS/c1-12-8-14(3)16(9-13(12)2)18(22)10-23-19-15-6-4-5-7-17(15)20-11-21-19/h4-9,11H,10H2,1-3H3