3-[3-(4-chloranyl-3-methyl-pyrazol-1-yl)propyl]-2-[(4-chlorophenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[3-(4-chloranyl-3-methyl-pyrazol-1-yl)propyl]-2-[(4-chlorophenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[3-(4-chloro-3-methyl-pyrazol-1-yl)propyl]-2-[(4-chlorophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[3-(4-chloro-3-methyl-1-pyrazolyl)propyl]-2-[(4-chlorophenyl)methylthio]-4-quinazolinone IUPAC Name: 3-[3-(4-chloro-3-methylpyrazol-1-yl)propyl]-2-[(4-chlorophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-3-[3-(4-chloro-3-methyl-pyrazol-1-yl)propyl]quinazolin-4-one Formula: C22H20Cl2N4OS MolecularWeight: 459.3914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Cl)CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C=C1Cl)CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20Cl2N4OS/c1-15-19(24)13-27(26-15)11-4-12-28-21(29)18-5-2-3-6-20(18)25-22(28)30-14-16-7-9-17(23)10-8-16/h2-3,5-10,13H,4,11-12,14H2,1H3