N-[4-[4-ethyl-5-(5-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-3-yl]phenyl]ethanamide

Systemtic Name: N-[4-[4-ethyl-5-(5-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-3-yl]phenyl]ethanamide Openeye Name: N-[4-[4-ethyl-5-[(5-nitro-2-pyridyl)sulfanyl]-1,2,4-triazol-3-yl]phenyl]acetamide CAS Name: N-[4-[4-ethyl-5-[(5-nitro-2-pyridinyl)thio]-1,2,4-triazol-3-yl]phenyl]acetamide IUPAC Name: N-[4-[4-ethyl-5-(5-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-3-yl]phenyl]acetamide Traditional Name: N-[4-[4-ethyl-5-[(5-nitro-2-pyridyl)thio]-1,2,4-triazol-3-yl]phenyl]acetamide Formula: C17H16N6O3S MolecularWeight: 384.41234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=NC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCN1C(=NN=C1SC2=NC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C17H16N6O3S/c1-3-22-16(12-4-6-13(7-5-12)19-11(2)24)20-21-17(22)27-15-9-8-14(10-18-15)23(25)26/h4-10H,3H2,1-2H3,(H,19,24)