5-bromanyl-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 5-bromanyl-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 5-bromo-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 5-bromo-2-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 5-bromo-2-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 5-bromo-2-(4-nosylpiperazino)pyrimidine Formula: C14H14BrN5O4S MolecularWeight: 428.26106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)Br)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)Br)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H14BrN5O4S/c15-11-9-16-14(17-10-11)18-5-7-19(8-6-18)25(23,24)13-3-1-12(2-4-13)20(21)22/h1-4,9-10H,5-8H2