2-chloranyl-5-[1-methyl-4,5-bis(trifluoromethyl)pyrazol-3-yl]-N-prop-2-ynyl-aniline

Systemtic Name: 2-chloranyl-5-[1-methyl-4,5-bis(trifluoromethyl)pyrazol-3-yl]-N-prop-2-ynyl-aniline Openeye Name: 2-chloro-5-[1-methyl-4,5-bis(trifluoromethyl)pyrazol-3-yl]-N-prop-2-ynyl-aniline CAS Name: 2-chloro-5-[1-methyl-4,5-bis(trifluoromethyl)-3-pyrazolyl]-N-prop-2-ynylaniline IUPAC Name: 2-chloro-5-[1-methyl-4,5-bis(trifluoromethyl)pyrazol-3-yl]-N-prop-2-ynylaniline Traditional Name: [2-chloro-5-[1-methyl-4,5-bis(trifluoromethyl)pyrazol-3-yl]phenyl]-propargyl-amine Formula: C15H10ClF6N3 MolecularWeight: 381.703419

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC(=C(C=C2)Cl)NCC#C)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC(=C(C=C2)Cl)NCC#C)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H10ClF6N3/c1-3-6-23-10-7-8(4-5-9(10)16)12-11(14(17,18)19)13(15(20,21)22)25(2)24-12/h1,4-5,7,23H,6H2,2H3