(4S)-N-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-2,2-dimethyl-oxan-4-amine

Systemtic Name: (4S)-N-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-2,2-dimethyl-oxan-4-amine Openeye Name: (4S)-N-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-2,2-dimethyl-tetrahydropyran-4-amine CAS Name: (4S)-N-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-2,2-dimethyl-4-oxanamine IUPAC Name: (4S)-N-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-2,2-dimethyloxan-4-amine Traditional Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-[(4S)-2,2-dimethyltetrahydropyran-4-yl]amine Formula: C19H27N3O MolecularWeight: 313.43718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=NN2)CNC3CCOC(C3)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=NN2)CN[C@H]3CCOC(C3)(C)C)C

InChI

InChI=1S/C19H27N3O/c1-13-5-6-15(9-14(13)2)18-16(12-21-22-18)11-20-17-7-8-23-19(3,4)10-17/h5-6,9,12,17,20H,7-8,10-11H2,1-4H3,(H,21,22)/t17-/m0/s1