5-[(S)-(4-methoxyphenyl)-[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol

Systemtic Name: 5-[(S)-(4-methoxyphenyl)-[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol Openeye Name: 5-[(S)-(4-methoxyphenyl)-[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-methyl-thiazolo[3,2-b][1,2,4]triazol-6-ol CAS Name: 5-[(S)-(4-methoxyphenyl)-[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-2-methyl-6-thiazolo[3,2-b][1,2,4]triazolol IUPAC Name: 5-[(S)-(4-methoxyphenyl)-[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol Traditional Name: 5-[(S)-(4-methoxyphenyl)-[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-2-methyl-thiazolo[3,2-b][1,2,4]triazol-6-ol Formula: C19H25N4O2S+ MolecularWeight: 373.4924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C2=CC=C(C=C2)OC)C3=C(N4C(=NC(=N4)C)S3)O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C2=CC=C(C=C2)OC)C3=C(N4C(=NC(=N4)C)S3)O

InChI

InChI=1S/C19H24N4O2S/c1-12-5-4-10-22(11-12)16(14-6-8-15(25-3)9-7-14)17-18(24)23-19(26-17)20-13(2)21-23/h6-9,12,16,24H,4-5,10-11H2,1-3H3/p+1/t12-,16-/m0/s1