6-[[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]oxy]pyridine-3-carboxamide

Systemtic Name: 6-[[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]oxy]pyridine-3-carboxamide Openeye Name: 6-[[2-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]oxy]pyridine-3-carboxamide CAS Name: 6-[[2-[(3R)-3-(1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazol-6-yl]oxy]-3-pyridinecarboxamide IUPAC Name: 6-[[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]oxy]pyridine-3-carboxamide Traditional Name: 6-[[2-[(3R)-3-piperidinopyrrolidino]-1,3-benzothiazol-6-yl]oxy]nicotinamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(C2)C3=NC4=C(S3)C=C(C=C4)OC5=NC=C(C=C5)C(=O)N

Isomeric SMILES

C1CCN(CC1)[C@@H]2CCN(C2)C3=NC4=C(S3)C=C(C=C4)OC5=NC=C(C=C5)C(=O)N

InChI

InChI=1S/C22H25N5O2S/c23-21(28)15-4-7-20(24-13-15)29-17-5-6-18-19(12-17)30-22(25-18)27-11-8-16(14-27)26-9-2-1-3-10-26/h4-7,12-13,16H,1-3,8-11,14H2,(H2,23,28)/t16-/m1/s1