3-nitro-4-(prop-2-ynylamino)-1H-pyridine-2-thione

Systemtic Name: 3-nitro-4-(prop-2-ynylamino)-1H-pyridine-2-thione Openeye Name: 3-nitro-4-(prop-2-ynylamino)-1H-pyridine-2-thione CAS Name: 3-nitro-4-(prop-2-ynylamino)-1H-pyridine-2-thione IUPAC Name: 3-nitro-4-(prop-2-ynylamino)-1H-pyridine-2-thione Traditional Name: 3-nitro-4-(propargylamino)-1H-pyridine-2-thione Formula: C8H7N3O2S MolecularWeight: 209.22508

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=C(C(=S)NC=C1)[N+](=O)[O-]

Isomeric SMILES

C#CCNC1=C(C(=S)NC=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H7N3O2S/c1-2-4-9-6-3-5-10-8(14)7(6)11(12)13/h1,3,5H,4H2,(H2,9,10,14)