4-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one

Systemtic Name: 4-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one Openeye Name: 4-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one CAS Name: 4-[5,6-dimethyl-2-(4-morpholin-4-iumylmethyl)-4-thieno[2,3-d]pyrimidinyl]-2-piperazinone IUPAC Name: 4-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one Traditional Name: 4-[5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-2-one Formula: C17H24N5O2S+ MolecularWeight: 362.46976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCNC(=O)C3)C[NH+]4CCOCC4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCNC(=O)C3)C[NH+]4CCOCC4)C

InChI

InChI=1S/C17H23N5O2S/c1-11-12(2)25-17-15(11)16(22-4-3-18-14(23)10-22)19-13(20-17)9-21-5-7-24-8-6-21/h3-10H2,1-2H3,(H,18,23)/p+1