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

Systemtic Name: 3-[(3-nitrophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[(3-nitrophenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-nitrophenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-nitrophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[(3-nitrobenzyl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]amine Formula: C13H11N5O2S2 MolecularWeight: 333.38874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=C(N2N)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=C(N2N)C3=CC=CS3

InChI

InChI=1S/C13H11N5O2S2/c14-17-12(11-5-2-6-21-11)15-16-13(17)22-8-9-3-1-4-10(7-9)18(19)20/h1-7H,8,14H2