4-(4-bromophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)-2-phenyl-pyrimidine

Systemtic Name: 4-(4-bromophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)-2-phenyl-pyrimidine Openeye Name: 4-(4-bromophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)-2-phenyl-pyrimidine CAS Name: 4-[(4-bromophenyl)thio]-6-(4-methyl-1-piperazinyl)-2-phenylpyrimidine IUPAC Name: 4-(4-bromophenyl)sulfanyl-6-(4-methylpiperazin-1-yl)-2-phenylpyrimidine Traditional Name: 4-[(4-bromophenyl)thio]-6-(4-methylpiperazino)-2-phenyl-pyrimidine Formula: C21H21BrN4S MolecularWeight: 441.38724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC(=N2)C3=CC=CC=C3)SC4=CC=C(C=C4)Br

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC(=N2)C3=CC=CC=C3)SC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4S/c1-25-11-13-26(14-12-25)19-15-20(27-18-9-7-17(22)8-10-18)24-21(23-19)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3