4-(pyridin-3-ylmethylamino)benzenecarbothioamide

Systemtic Name: 4-(pyridin-3-ylmethylamino)benzenecarbothioamide Openeye Name: 4-(3-pyridylmethylamino)benzenecarbothioamide CAS Name: 4-(3-pyridinylmethylamino)benzenecarbothioamide IUPAC Name: 4-(pyridin-3-ylmethylamino)benzenecarbothioamide Traditional Name: 4-(3-pyridylmethylamino)thiobenzamide Formula: C13H13N3S MolecularWeight: 243.32742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1=CC(=CN=C1)CNC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C13H13N3S/c14-13(17)11-3-5-12(6-4-11)16-9-10-2-1-7-15-8-10/h1-8,16H,9H2,(H2,14,17)