3-[(3-nitrophenyl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3-nitrophenyl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine Openeye Name: 3-[(3-nitrophenyl)methylsulfanyl]-5-(3-pyridyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-nitrophenyl)methylthio]-5-(3-pyridinyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-nitrophenyl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-nitrobenzyl)thio]-5-(3-pyridyl)-1,2,4-triazol-4-yl]amine Formula: C14H12N6O2S MolecularWeight: 328.34908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=C(N2N)C3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=C(N2N)C3=CN=CC=C3

InChI

InChI=1S/C14H12N6O2S/c15-19-13(11-4-2-6-16-8-11)17-18-14(19)23-9-10-3-1-5-12(7-10)20(21)22/h1-8H,9,15H2