3-[5-(4-chloranyl-2-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[5-(4-chloranyl-2-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-(4-chloro-2-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-[(4-chloro-2-nitrophenyl)thio]-4-phenyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-(4-chloro-2-nitrophenyl)sulfanyl-4-phenyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[(4-chloro-2-nitro-phenyl)thio]-4-phenyl-1,2,4-triazol-3-yl]pyridine Formula: C19H12ClN5O2S MolecularWeight: 409.84888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C4=CN=CC=C4

InChI

InChI=1S/C19H12ClN5O2S/c20-14-8-9-17(16(11-14)25(26)27)28-19-23-22-18(13-5-4-10-21-12-13)24(19)15-6-2-1-3-7-15/h1-12H