1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)ethanamine

Systemtic Name: 1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)ethanamine Openeye Name: 1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]-N-(2-thienylmethyl)ethanamine CAS Name: 1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]-N-(thiophen-2-ylmethyl)ethanamine IUPAC Name: 1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]-N-(thiophen-2-ylmethyl)ethanamine Traditional Name: 1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl-(2-thenyl)amine Formula: C19H28N4S MolecularWeight: 344.51742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NCC2=CC=CS2)N3CCCCCCC3

Isomeric SMILES

CC1=NC(=NC=C1C(C)NCC2=CC=CS2)N3CCCCCCC3

InChI

InChI=1S/C19H28N4S/c1-15(20-13-17-9-8-12-24-17)18-14-21-19(22-16(18)2)23-10-6-4-3-5-7-11-23/h8-9,12,14-15,20H,3-7,10-11,13H2,1-2H3