N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]but-3-enamide

Systemtic Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]but-3-enamide Openeye Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]but-3-enamide CAS Name: N-[1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]-3-butenamide IUPAC Name: N-[1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]but-3-enamide Traditional Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]but-3-enamide Formula: C18H28N4O MolecularWeight: 316.44112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)CC=C)N2CCCCCCC2

Isomeric SMILES

CC1=NC(=NC=C1C(C)NC(=O)CC=C)N2CCCCCCC2

InChI

InChI=1S/C18H28N4O/c1-4-10-17(23)20-14(2)16-13-19-18(21-15(16)3)22-11-8-6-5-7-9-12-22/h4,13-14H,1,5-12H2,2-3H3,(H,20,23)