1-(1,3-benzodioxol-5-yl)-3-pyridin-4-yl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-pyridin-4-yl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(4-pyridyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-pyridin-4-ylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-pyridin-4-ylthiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(4-pyridyl)thiourea Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=NC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=NC=C3

InChI

InChI=1S/C13H11N3O2S/c19-13(15-9-3-5-14-6-4-9)16-10-1-2-11-12(7-10)18-8-17-11/h1-7H,8H2,(H2,14,15,16,19)