2-(morpholin-4-ium-4-ylmethyl)-3-(3-phenylpropyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(morpholin-4-ium-4-ylmethyl)-3-(3-phenylpropyl)-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(morpholin-4-ium-4-ylmethyl)-3-(3-phenylpropyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(4-morpholin-4-iumylmethyl)-3-(3-phenylpropyl)-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(morpholin-4-ium-4-ylmethyl)-3-(3-phenylpropyl)-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(morpholin-4-ium-4-ylmethyl)-3-(3-phenylpropyl)-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C24H26N3O2S2+ MolecularWeight: 452.61214

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CCCC5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CCCC5=CC=CC=C5

InChI

InChI=1S/C24H25N3O2S2/c28-24-22-19(20-9-5-15-30-20)17-31-23(22)25-21(16-26-11-13-29-14-12-26)27(24)10-4-8-18-6-2-1-3-7-18/h1-3,5-7,9,15,17H,4,8,10-14,16H2/p+1