1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitro-phenyl]piperidine

Systemtic Name: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitro-phenyl]piperidine Openeye Name: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitro-phenyl]piperidine CAS Name: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]-4-nitrophenyl]piperidine IUPAC Name: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl]piperidine Traditional Name: 1-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]-4-nitro-phenyl]piperidine Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=C(C=CC(=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1SC2=C(C=CC(=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O2S/c1-17-10-15-16-14(17)22-13-9-11(5-6-12(13)19(20)21)18-7-3-2-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3