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

Systemtic Name: N-(3-ethoxypropyl)-5-(5-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-ethoxypropyl)-5-[(5-nitro-2-pyridyl)sulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(3-ethoxypropyl)-5-[(5-nitro-2-pyridinyl)thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-ethoxypropyl)-5-(5-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: 3-ethoxypropyl-[5-[(5-nitro-2-pyridyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C12H15N5O3S2 MolecularWeight: 341.4092

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NN=C(S1)SC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOCCCNC1=NN=C(S1)SC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N5O3S2/c1-2-20-7-3-6-13-11-15-16-12(22-11)21-10-5-4-9(8-14-10)17(18)19/h4-5,8H,2-3,6-7H2,1H3,(H,13,15)