N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[(1S)-1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]-2-methylpyrazole-3-carboxamide Traditional Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-2-methyl-pyrazole-3-carboxamide Formula: C19H28N6O MolecularWeight: 356.46522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)C2=CC=NN2C)N3CCCCCCC3

Isomeric SMILES

CC1=NC(=NC=C1[C@H](C)NC(=O)C2=CC=NN2C)N3CCCCCCC3

InChI

InChI=1S/C19H28N6O/c1-14(22-18(26)17-9-10-21-24(17)3)16-13-20-19(23-15(16)2)25-11-7-5-4-6-8-12-25/h9-10,13-14H,4-8,11-12H2,1-3H3,(H,22,26)/t14-/m0/s1