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

Systemtic Name: 6-tert-butyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thieno[3,2-d]pyrimidin-4-amine Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-6-tert-butyl-thieno[3,2-d]pyrimidin-4-amine CAS Name: 6-tert-butyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-thieno[3,2-d]pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-6-tert-butylthieno[3,2-d]pyrimidin-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(6-tert-butylthieno[3,2-d]pyrimidin-4-yl)amine Formula: C22H29N4S+ MolecularWeight: 381.55746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(S1)C(=NC=N2)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC2=C(S1)C(=NC=N2)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H28N4S/c1-22(2,3)19-13-18-20(27-19)21(24-15-23-18)25-17-9-11-26(12-10-17)14-16-7-5-4-6-8-16/h4-8,13,15,17H,9-12,14H2,1-3H3,(H,23,24,25)/p+1