N-[(2S)-3-methylbutan-2-yl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(2S)-3-methylbutan-2-yl]-2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [(1S)-1,2-dimethylpropyl]-[2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C20H27N4OS2+ MolecularWeight: 403.58458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4

Isomeric SMILES

C[C@@H](C(C)C)NC1=C2C(=CSC2=NC(=N1)C[NH+]3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C20H26N4OS2/c1-13(2)14(3)21-19-18-15(16-5-4-10-26-16)12-27-20(18)23-17(22-19)11-24-6-8-25-9-7-24/h4-5,10,12-14H,6-9,11H2,1-3H3,(H,21,22,23)/p+1/t14-/m0/s1