(2S)-2-acetamido-N-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-(1-methylpyrrol-2-yl)propanamide

Systemtic Name: (2S)-2-acetamido-N-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-(1-methylpyrrol-2-yl)propanamide Openeye Name: (2S)-2-acetamido-N-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]-3-(1-methylpyrrol-2-yl)propanamide CAS Name: (2S)-2-acetamido-N-[1-(4,6-dimethyl-2-pyrimidinyl)-4-piperidinyl]-3-(1-methyl-2-pyrrolyl)propanamide IUPAC Name: (2S)-2-acetamido-N-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-3-(1-methylpyrrol-2-yl)propanamide Traditional Name: (2S)-2-acetamido-N-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]-3-(1-methylpyrrol-2-yl)propionamide Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)NC(=O)C(CC3=CC=CN3C)NC(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)NC(=O)[C@H](CC3=CC=CN3C)NC(=O)C)C

InChI

InChI=1S/C21H30N6O2/c1-14-12-15(2)23-21(22-14)27-10-7-17(8-11-27)25-20(29)19(24-16(3)28)13-18-6-5-9-26(18)4/h5-6,9,12,17,19H,7-8,10-11,13H2,1-4H3,(H,24,28)(H,25,29)/t19-/m0/s1