5-[[(1R,2R)-2-oxidanylcyclooctyl]methylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide

Systemtic Name: 5-[[(1R,2R)-2-oxidanylcyclooctyl]methylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Openeye Name: 5-[[(1R,2R)-2-hydroxycyclooctyl]methylcarbamoylamino]-3-(3-pyridylmethoxy)isothiazole-4-carboxamide CAS Name: 5-[[[[(1R,2R)-2-hydroxycyclooctyl]methylamino]-oxomethyl]amino]-3-(3-pyridinylmethoxy)-4-isothiazolecarboxamide IUPAC Name: 5-[[(1R,2R)-2-hydroxycyclooctyl]methylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Traditional Name: 5-[[(1R,2R)-2-hydroxycyclooctyl]methylcarbamoylamino]-3-(3-pyridylmethoxy)isothiazole-4-carboxamide Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(C(CC1)CNC(=O)NC2=C(C(=NS2)OCC3=CN=CC=C3)C(=O)N)O

Isomeric SMILES

C1CCC[C@H]([C@H](CC1)CNC(=O)NC2=C(C(=NS2)OCC3=CN=CC=C3)C(=O)N)O

InChI

InChI=1S/C20H27N5O4S/c21-17(27)16-18(29-12-13-6-5-9-22-10-13)25-30-19(16)24-20(28)23-11-14-7-3-1-2-4-8-15(14)26/h5-6,9-10,14-15,26H,1-4,7-8,11-12H2,(H2,21,27)(H2,23,24,28)/t14-,15-/m1/s1