2-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one

Systemtic Name: 2-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one Openeye Name: 2-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one CAS Name: 2-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-3-cyclopropyl-4-quinazolinone IUPAC Name: 2-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-3-cyclopropylquinazolin-4-one Traditional Name: 2-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-3-cyclopropyl-quinazolin-4-one Formula: C22H19ClN4OS MolecularWeight: 422.93046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C22H19ClN4OS/c1-14-18(20(23)27(25-14)16-7-3-2-4-8-16)13-29-22-24-19-10-6-5-9-17(19)21(28)26(22)15-11-12-15/h2-10,15H,11-13H2,1H3