3-[[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methylideneamino]-2-methyl-quinazolin-4-one

Systemtic Name: 3-[[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methylideneamino]-2-methyl-quinazolin-4-one Openeye Name: 3-[(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyleneamino]-2-methyl-quinazolin-4-one CAS Name: 3-[[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]methylideneamino]-2-methyl-4-quinazolinone IUPAC Name: 3-[[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methylideneamino]-2-methylquinazolin-4-one Traditional Name: 3-[(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyleneamino]-2-methyl-quinazolin-4-one Formula: C18H20ClN5O MolecularWeight: 357.8373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NN2C(=NC3=CC=CC=C3C2=O)C)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C=NN2C(=NC3=CC=CC=C3C2=O)C)Cl)CC(C)C

InChI

InChI=1S/C18H20ClN5O/c1-11(2)10-23-17(19)15(12(3)22-23)9-20-24-13(4)21-16-8-6-5-7-14(16)18(24)25/h5-9,11H,10H2,1-4H3