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

Systemtic Name: N-[3-[3-methyl-5-(5-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-methyl-5-[(5-nitro-2-pyridyl)sulfanyl]-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-methyl-5-[(5-nitro-2-pyridinyl)thio]-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-methyl-5-(5-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-methyl-5-[(5-nitro-2-pyridyl)thio]-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C16H14N6O3S MolecularWeight: 370.38576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)SC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)SC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O3S/c1-10-19-20-16(26-15-7-6-14(9-17-15)22(24)25)21(10)13-5-3-4-12(8-13)18-11(2)23/h3-9H,1-2H3,(H,18,23)