6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyridine-3-carbothioamide

Systemtic Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyridine-3-carbothioamide Openeye Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyridine-3-carbothioamide CAS Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-pyridinecarbothioamide IUPAC Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyridine-3-carbothioamide Traditional Name: 6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)thionicotinamide Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC=C(C=C3)C(=S)N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC=C(C=C3)C(=S)N

InChI

InChI=1S/C14H13N3O2S/c15-14(20)9-1-4-13(16-8-9)17-10-2-3-11-12(7-10)19-6-5-18-11/h1-4,7-8H,5-6H2,(H2,15,20)(H,16,17)