N-(furan-2-ylmethyl)-5-(3-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(furan-2-ylmethyl)-5-(3-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-(2-furylmethyl)-5-[(3-nitro-2-pyridyl)sulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(2-furanylmethyl)-5-[(3-nitro-2-pyridinyl)thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(furan-2-ylmethyl)-5-(3-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: 2-furfuryl-[5-[(3-nitro-2-pyridyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C12H9N5O3S2 MolecularWeight: 335.36156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC2=NN=C(S2)NCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SC2=NN=C(S2)NCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O3S2/c18-17(19)9-4-1-5-13-10(9)21-12-16-15-11(22-12)14-7-8-3-2-6-20-8/h1-6H,7H2,(H,14,15)