[6-(aminomethyl)-5-[2-(4-isothiocyanatophenyl)ethynyl]pyridin-2-yl]methanamine

Systemtic Name: [6-(aminomethyl)-5-[2-(4-isothiocyanatophenyl)ethynyl]pyridin-2-yl]methanamine Openeye Name: [6-(aminomethyl)-5-[2-(4-isothiocyanatophenyl)ethynyl]-2-pyridyl]methanamine CAS Name: [6-(aminomethyl)-5-[2-(4-isothiocyanatophenyl)ethynyl]-2-pyridinyl]methanamine IUPAC Name: [6-(aminomethyl)-5-[2-(4-isothiocyanatophenyl)ethynyl]pyridin-2-yl]methanamine Traditional Name: [6-(aminomethyl)-3-[2-(4-isothiocyanatophenyl)ethynyl]-2-pyridyl]methylamine Formula: C16H14N4S MolecularWeight: 294.37416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=C(N=C(C=C2)CN)CN)N=C=S

Isomeric SMILES

C1=CC(=CC=C1C#CC2=C(N=C(C=C2)CN)CN)N=C=S

InChI

InChI=1S/C16H14N4S/c17-9-15-8-5-13(16(10-18)20-15)4-1-12-2-6-14(7-3-12)19-11-21/h2-3,5-8H,9-10,17-18H2