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N-(benzotriazol-1-ylmethyl)pyridine-4-carbothioamide

N-(benzotriazol-1-ylmethyl)pyridine-4-carbothioamide

Systemtic Name:N-(benzotriazol-1-ylmethyl)pyridine-4-carbothioamide
Openeye Name:N-(benzotriazol-1-ylmethyl)pyridine-4-carbothioamide
CAS Name:N-(1-benzotriazolylmethyl)-4-pyridinecarbothioamide
IUPAC Name:N-(benzotriazol-1-ylmethyl)pyridine-4-carbothioamide
Traditional Name:N-(benzotriazol-1-ylmethyl)thioisonicotinamide
Formula: C13H11N5S
MolecularWeight: 269.32494
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC(=S)C3=CC=NC=C3


Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC(=S)C3=CC=NC=C3


InChI

InChI=1S/C13H11N5S/c19-13(10-5-7-14-8-6-10)15-9-18-12-4-2-1-3-11(12)16-17-18/h1-8H,9H2,(H,15,19)


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