(2,6-dimethylpyrimidin-4-yl)-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]methanone

Systemtic Name: (2,6-dimethylpyrimidin-4-yl)-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]methanone Openeye Name: (2,6-dimethylpyrimidin-4-yl)-[(3S)-3-(4-isopropylanilino)-1-piperidyl]methanone CAS Name: (2,6-dimethyl-4-pyrimidinyl)-[(3S)-3-(4-propan-2-ylanilino)-1-piperidinyl]methanone IUPAC Name: (2,6-dimethylpyrimidin-4-yl)-[(3S)-3-(4-propan-2-ylanilino)piperidin-1-yl]methanone Traditional Name: [(3S)-3-cumidinopiperidino]-(2,6-dimethylpyrimidin-4-yl)methanone Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)N2CCCC(C2)NC3=CC=C(C=C3)C(C)C)C

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)N2CCC[C@@H](C2)NC3=CC=C(C=C3)C(C)C)C

InChI

InChI=1S/C21H28N4O/c1-14(2)17-7-9-18(10-8-17)24-19-6-5-11-25(13-19)21(26)20-12-15(3)22-16(4)23-20/h7-10,12,14,19,24H,5-6,11,13H2,1-4H3/t19-/m0/s1