3-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole

Systemtic Name: 3-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-ium-1-yl]methyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidin-1-iumyl]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-ium-1-yl]methyl]-5-(2-thienyl)isoxazole Formula: C19H18N3OS2+ MolecularWeight: 368.49572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=NOC(=C2)C3=CC=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=NOC(=C2)C3=CC=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C19H17N3OS2/c1-2-7-17-14(5-1)20-19(25-17)15-6-3-9-22(15)12-13-11-16(23-21-13)18-8-4-10-24-18/h1-2,4-5,7-8,10-11,15H,3,6,9,12H2/p+1/t15-/m1/s1