4,6-bis[(2-bromophenyl)sulfanyl]-5-nitro-pyrimidine

Systemtic Name: 4,6-bis[(2-bromophenyl)sulfanyl]-5-nitro-pyrimidine Openeye Name: 4,6-bis[(2-bromophenyl)sulfanyl]-5-nitro-pyrimidine CAS Name: 4,6-bis[(2-bromophenyl)thio]-5-nitropyrimidine IUPAC Name: 4,6-bis[(2-bromophenyl)sulfanyl]-5-nitropyrimidine Traditional Name: 4,6-bis[(2-bromophenyl)thio]-5-nitro-pyrimidine Formula: C16H9Br2N3O2S2 MolecularWeight: 499.19956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SC2=C(C(=NC=N2)SC3=CC=CC=C3Br)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)SC2=C(C(=NC=N2)SC3=CC=CC=C3Br)[N+](=O)[O-])Br

InChI

InChI=1S/C16H9Br2N3O2S2/c17-10-5-1-3-7-12(10)24-15-14(21(22)23)16(20-9-19-15)25-13-8-4-2-6-11(13)18/h1-9H