6-(4-methoxyphenyl)-3-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 6-(4-methoxyphenyl)-3-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-6-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propyl]-6-(4-methoxyphenyl)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]-6-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-6-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4-one Formula: C20H24N3O4S+ MolecularWeight: 402.48726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC3=C(S2)C(=O)N(C=N3)CC(C[NH+]4CCOCC4)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC3=C(S2)C(=O)N(C=N3)C[C@@H](C[NH+]4CCOCC4)O

InChI

InChI=1S/C20H23N3O4S/c1-26-16-4-2-14(3-5-16)18-10-17-19(28-18)20(25)23(13-21-17)12-15(24)11-22-6-8-27-9-7-22/h2-5,10,13,15,24H,6-9,11-12H2,1H3/p+1/t15-/m1/s1