5,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C20H25N4S+ MolecularWeight: 353.5043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C20H24N4S/c1-14-15(2)25-20-18(14)19(21-13-22-20)23-17-8-10-24(11-9-17)12-16-6-4-3-5-7-16/h3-7,13,17H,8-12H2,1-2H3,(H,21,22,23)/p+1