1-(pyridin-3-ylmethyl)-3-[(E)-pyridin-2-ylmethylideneamino]thiourea

Systemtic Name: 1-(pyridin-3-ylmethyl)-3-[(E)-pyridin-2-ylmethylideneamino]thiourea Openeye Name: 1-(3-pyridylmethyl)-3-[(E)-2-pyridylmethyleneamino]thiourea CAS Name: 1-(3-pyridinylmethyl)-3-[(E)-2-pyridinylmethylideneamino]thiourea IUPAC Name: 1-(pyridin-3-ylmethyl)-3-[(E)-pyridin-2-ylmethylideneamino]thiourea Traditional Name: 1-(3-pyridylmethyl)-3-[(E)-2-pyridylmethyleneamino]thiourea Formula: C13H13N5S MolecularWeight: 271.34082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C=NNC(=S)NCC2=CN=CC=C2

Isomeric SMILES

C1=CC=NC(=C1)/C=N/NC(=S)NCC2=CN=CC=C2

InChI

InChI=1S/C13H13N5S/c19-13(16-9-11-4-3-6-14-8-11)18-17-10-12-5-1-2-7-15-12/h1-8,10H,9H2,(H2,16,18,19)/b17-10+