4-azanyl-2-(3-chloranyl-4-methyl-phenyl)-1-methyl-5-propan-2-yl-pyrazol-3-one

Systemtic Name: 4-azanyl-2-(3-chloranyl-4-methyl-phenyl)-1-methyl-5-propan-2-yl-pyrazol-3-one Openeye Name: 4-amino-2-(3-chloro-4-methyl-phenyl)-5-isopropyl-1-methyl-pyrazol-3-one CAS Name: 4-amino-2-(3-chloro-4-methylphenyl)-1-methyl-5-propan-2-yl-3-pyrazolone IUPAC Name: 4-amino-2-(3-chloro-4-methylphenyl)-1-methyl-5-propan-2-ylpyrazol-3-one Traditional Name: 4-amino-2-(3-chloro-4-methyl-phenyl)-5-isopropyl-1-methyl-3-pyrazolin-3-one Formula: C14H18ClN3O MolecularWeight: 279.76522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=C(N2C)C(C)C)N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=C(N2C)C(C)C)N)Cl

InChI

InChI=1S/C14H18ClN3O/c1-8(2)13-12(16)14(19)18(17(13)4)10-6-5-9(3)11(15)7-10/h5-8H,16H2,1-4H3