[4-[(3S)-4-[(1S)-2-cyclopropyl-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazin-1-yl]-4-methyl-piperidin-1-yl]-(4,6-dimethylpyrimidin-5-yl)methanone

Systemtic Name: [4-[(3S)-4-[(1S)-2-cyclopropyl-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazin-1-yl]-4-methyl-piperidin-1-yl]-(4,6-dimethylpyrimidin-5-yl)methanone Openeye Name: [4-[(3S)-4-[(1S)-2-cyclopropyl-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazin-1-yl]-4-methyl-1-piperidyl]-(4,6-dimethylpyrimidin-5-yl)methanone CAS Name: [4-[(3S)-4-[(1S)-2-cyclopropyl-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-piperazinyl]-4-methyl-1-piperidinyl]-(4,6-dimethyl-5-pyrimidinyl)methanone IUPAC Name: [4-[(3S)-4-[(1S)-2-cyclopropyl-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methylpiperazin-1-yl]-4-methylpiperidin-1-yl]-(4,6-dimethylpyrimidin-5-yl)methanone Traditional Name: [4-[(3S)-4-[(1S)-2-cyclopropyl-1-[4-(trifluoromethyl)phenyl]ethyl]-3-methyl-piperazino]-4-methyl-piperidino]-(4,6-dimethylpyrimidin-5-yl)methanone Formula: C30H40F3N5O MolecularWeight: 543.66671

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(CC2CC2)C3=CC=C(C=C3)C(F)(F)F)C4(CCN(CC4)C(=O)C5=C(N=CN=C5C)C)C

Isomeric SMILES

C[C@H]1CN(CCN1[C@@H](CC2CC2)C3=CC=C(C=C3)C(F)(F)F)C4(CCN(CC4)C(=O)C5=C(N=CN=C5C)C)C

InChI

InChI=1S/C30H40F3N5O/c1-20-18-37(29(4)11-13-36(14-12-29)28(39)27-21(2)34-19-35-22(27)3)15-16-38(20)26(17-23-5-6-23)24-7-9-25(10-8-24)30(31,32)33/h7-10,19-20,23,26H,5-6,11-18H2,1-4H3/t20-,26-/m0/s1