2-[4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(2-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-ium-1-yl]ethanol Formula: C17H21N4OS2+ MolecularWeight: 361.50484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CC[NH+](CC4)CCO

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=CS3)N4CC[NH+](CC4)CCO

InChI

InChI=1S/C17H20N4OS2/c1-12-18-16(21-6-4-20(5-7-21)8-9-22)15-13(11-24-17(15)19-12)14-3-2-10-23-14/h2-3,10-11,22H,4-9H2,1H3/p+1