2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanylpyrimidine

Systemtic Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanylpyrimidine Openeye Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)sulfanylpyrimidine CAS Name: 2-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]thio]pyrimidine IUPAC Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)sulfanylpyrimidine Traditional Name: 2-[(2-nitro-4-pyrrolidinosulfonyl-phenyl)thio]pyrimidine Formula: C14H14N4O4S2 MolecularWeight: 366.41536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O4S2/c19-18(20)12-10-11(24(21,22)17-8-1-2-9-17)4-5-13(12)23-14-15-6-3-7-16-14/h3-7,10H,1-2,8-9H2