3-(3-nitropyridin-2-yl)sulfanyl-5,6-diphenyl-1,2,4-triazine

Systemtic Name: 3-(3-nitropyridin-2-yl)sulfanyl-5,6-diphenyl-1,2,4-triazine Openeye Name: 3-[(3-nitro-2-pyridyl)sulfanyl]-5,6-diphenyl-1,2,4-triazine CAS Name: 3-[(3-nitro-2-pyridinyl)thio]-5,6-diphenyl-1,2,4-triazine IUPAC Name: 3-(3-nitropyridin-2-yl)sulfanyl-5,6-diphenyl-1,2,4-triazine Traditional Name: 3-[(3-nitro-2-pyridyl)thio]-5,6-diphenyl-1,2,4-triazine Formula: C20H13N5O2S MolecularWeight: 387.41452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SC3=C(C=CC=N3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SC3=C(C=CC=N3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H13N5O2S/c26-25(27)16-12-7-13-21-19(16)28-20-22-17(14-8-3-1-4-9-14)18(23-24-20)15-10-5-2-6-11-15/h1-13H