N-[(2,4-dichlorophenyl)methyl]-2-([1,2,3]triazolo[4,5-b]pyridin-3-yloxymethyl)morpholine-4-carbothioamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-2-([1,2,3]triazolo[4,5-b]pyridin-3-yloxymethyl)morpholine-4-carbothioamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-2-(triazolo[4,5-b]pyridin-3-yloxymethyl)morpholine-4-carbothioamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-2-(3-triazolo[4,5-b]pyridinyloxymethyl)-4-morpholinecarbothioamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-2-(triazolo[4,5-b]pyridin-3-yloxymethyl)morpholine-4-carbothioamide Traditional Name: N-(2,4-dichlorobenzyl)-2-(triazolo[4,5-b]pyridin-3-yloxymethyl)morpholine-4-carbothioamide Formula: C18H18Cl2N6O2S MolecularWeight: 453.34552

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=S)NCC2=C(C=C(C=C2)Cl)Cl)CON3C4=C(C=CC=N4)N=N3

Isomeric SMILES

C1COC(CN1C(=S)NCC2=C(C=C(C=C2)Cl)Cl)CON3C4=C(C=CC=N4)N=N3

InChI

InChI=1S/C18H18Cl2N6O2S/c19-13-4-3-12(15(20)8-13)9-22-18(29)25-6-7-27-14(10-25)11-28-26-17-16(23-24-26)2-1-5-21-17/h1-5,8,14H,6-7,9-11H2,(H,22,29)