2-[4-[(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]piperidin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-[(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(2-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)amino]-1-piperidin-1-iumyl]acetamide IUPAC Name: 2-[4-[(2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]piperidin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-ium-1-yl]acetamide Formula: C18H22N5OS2+ MolecularWeight: 388.53018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)NC4CC[NH+](CC4)CC(=O)N

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)NC4CC[NH+](CC4)CC(=O)N

InChI

InChI=1S/C18H21N5OS2/c1-11-20-17(22-12-4-6-23(7-5-12)9-15(19)24)16-13(10-26-18(16)21-11)14-3-2-8-25-14/h2-3,8,10,12H,4-7,9H2,1H3,(H2,19,24)(H,20,21,22)/p+1