[(2S)-4-[(3-methoxyphenyl)methyl]-2-methyl-piperazin-1-yl]-(1-propan-2-ylpyrazol-4-yl)methanone

Systemtic Name: [(2S)-4-[(3-methoxyphenyl)methyl]-2-methyl-piperazin-1-yl]-(1-propan-2-ylpyrazol-4-yl)methanone Openeye Name: (1-isopropylpyrazol-4-yl)-[(2S)-4-[(3-methoxyphenyl)methyl]-2-methyl-piperazin-1-yl]methanone CAS Name: [(2S)-4-[(3-methoxyphenyl)methyl]-2-methyl-1-piperazinyl]-(1-propan-2-yl-4-pyrazolyl)methanone IUPAC Name: [(2S)-4-[(3-methoxyphenyl)methyl]-2-methylpiperazin-1-yl]-(1-propan-2-ylpyrazol-4-yl)methanone Traditional Name: (1-isopropylpyrazol-4-yl)-[(2S)-4-m-anisyl-2-methyl-piperazino]methanone Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CN(N=C2)C(C)C)CC3=CC(=CC=C3)OC

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)C2=CN(N=C2)C(C)C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H28N4O2/c1-15(2)24-14-18(11-21-24)20(25)23-9-8-22(12-16(23)3)13-17-6-5-7-19(10-17)26-4/h5-7,10-11,14-16H,8-9,12-13H2,1-4H3/t16-/m0/s1