3-(4-nitrophenyl)-6-phenyl-5-phenylsulfanyl-1,2,4-triazine

Systemtic Name: 3-(4-nitrophenyl)-6-phenyl-5-phenylsulfanyl-1,2,4-triazine Openeye Name: 3-(4-nitrophenyl)-6-phenyl-5-phenylsulfanyl-1,2,4-triazine CAS Name: 3-(4-nitrophenyl)-6-phenyl-5-(phenylthio)-1,2,4-triazine IUPAC Name: 3-(4-nitrophenyl)-6-phenyl-5-phenylsulfanyl-1,2,4-triazine Traditional Name: 3-(4-nitrophenyl)-6-phenyl-5-(phenylthio)-1,2,4-triazine Formula: C21H14N4O2S MolecularWeight: 386.42646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N=N2)C3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N=N2)C3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=CC=C4

InChI

InChI=1S/C21H14N4O2S/c26-25(27)17-13-11-16(12-14-17)20-22-21(28-18-9-5-2-6-10-18)19(23-24-20)15-7-3-1-4-8-15/h1-14H