N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-1-methyl-6-oxo-pyridazine-3-carboxamide CAS Name: N-[(1S)-1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]-1-methyl-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]-1-methyl-6-oxopyridazine-3-carboxamide Traditional Name: N-[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-6-keto-1-methyl-pyridazine-3-carboxamide Formula: C20H28N6O2 MolecularWeight: 384.47532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)C2=NN(C(=O)C=C2)C)N3CCCCCCC3

Isomeric SMILES

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

InChI

InChI=1S/C20H28N6O2/c1-14(22-19(28)17-9-10-18(27)25(3)24-17)16-13-21-20(23-15(16)2)26-11-7-5-4-6-8-12-26/h9-10,13-14H,4-8,11-12H2,1-3H3,(H,22,28)/t14-/m0/s1