2-(2-hydroxyethylsulfanyl)-3-(2-morpholin-4-ium-4-ylethyl)-6-phenyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-(2-hydroxyethylsulfanyl)-3-(2-morpholin-4-ium-4-ylethyl)-6-phenyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-(2-hydroxyethylsulfanyl)-3-(2-morpholin-4-ium-4-ylethyl)-6-phenyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-(2-hydroxyethylthio)-3-[2-(4-morpholin-4-iumyl)ethyl]-6-phenyl-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-(2-hydroxyethylsulfanyl)-3-(2-morpholin-4-ium-4-ylethyl)-6-phenylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-(2-hydroxyethylthio)-3-(2-morpholin-4-ium-4-ylethyl)-6-phenyl-thieno[3,2-d]pyrimidin-4-one Formula: C20H24N3O3S2+ MolecularWeight: 418.55286

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C(=O)C3=C(C=C(S3)C4=CC=CC=C4)N=C2SCCO

Isomeric SMILES

C1COCC[NH+]1CCN2C(=O)C3=C(C=C(S3)C4=CC=CC=C4)N=C2SCCO

InChI

InChI=1S/C20H23N3O3S2/c24-10-13-27-20-21-16-14-17(15-4-2-1-3-5-15)28-18(16)19(25)23(20)7-6-22-8-11-26-12-9-22/h1-5,14,24H,6-13H2/p+1