6-[(2-chlorophenyl)methylamino]pyridine-3-carbothioamide

Systemtic Name: 6-[(2-chlorophenyl)methylamino]pyridine-3-carbothioamide Openeye Name: 6-[(2-chlorophenyl)methylamino]pyridine-3-carbothioamide CAS Name: 6-[(2-chlorophenyl)methylamino]-3-pyridinecarbothioamide IUPAC Name: 6-[(2-chlorophenyl)methylamino]pyridine-3-carbothioamide Traditional Name: 6-[(2-chlorobenzyl)amino]thionicotinamide Formula: C13H12ClN3S MolecularWeight: 277.77248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC=C(C=C2)C(=S)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC=C(C=C2)C(=S)N)Cl

InChI

InChI=1S/C13H12ClN3S/c14-11-4-2-1-3-9(11)7-16-12-6-5-10(8-17-12)13(15)18/h1-6,8H,7H2,(H2,15,18)(H,16,17)