N-[3-(imidazol-1-ylmethyl)phenyl]pyridine-2-carbothioamide

Systemtic Name: N-[3-(imidazol-1-ylmethyl)phenyl]pyridine-2-carbothioamide Openeye Name: N-[3-(imidazol-1-ylmethyl)phenyl]pyridine-2-carbothioamide CAS Name: N-[3-(1-imidazolylmethyl)phenyl]-2-pyridinecarbothioamide IUPAC Name: N-[3-(imidazol-1-ylmethyl)phenyl]pyridine-2-carbothioamide Traditional Name: N-[3-(imidazol-1-ylmethyl)phenyl]thiopicolinamide Formula: C16H14N4S MolecularWeight: 294.37416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=S)NC2=CC=CC(=C2)CN3C=CN=C3

Isomeric SMILES

C1=CC=NC(=C1)C(=S)NC2=CC=CC(=C2)CN3C=CN=C3

InChI

InChI=1S/C16H14N4S/c21-16(15-6-1-2-7-18-15)19-14-5-3-4-13(10-14)11-20-9-8-17-12-20/h1-10,12H,11H2,(H,19,21)