N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butan-2-amine

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butan-2-amine Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butan-2-amine CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-butanamine IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]butan-2-amine Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-sec-butyl-amine Formula: C16H23N3 MolecularWeight: 257.37392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CCC(C)NCC1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C16H23N3/c1-5-12(2)17-11-16-13(3)18-19(14(16)4)15-9-7-6-8-10-15/h6-10,12,17H,5,11H2,1-4H3