1-[4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-propan-2-yl-pyrazol-4-yl]carbonyl-2-methyl-piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-propan-2-yl-pyrazol-4-yl]carbonyl-2-methyl-piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-isopropyl-pyrazole-4-carbonyl]-2-methyl-piperazin-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-[[1-[4-(4-bromophenyl)-2-thiazolyl]-5-propan-2-yl-4-pyrazolyl]-oxomethyl]-2-methyl-1-piperazinyl]-2-phenylethanone IUPAC Name: 1-[4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-propan-2-ylpyrazole-4-carbonyl]-2-methylpiperazin-1-yl]-2-phenylethanone Traditional Name: 1-[4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-isopropyl-pyrazole-4-carbonyl]-2-methyl-piperazino]-2-phenyl-ethanone Formula: C29H30BrN5O2S MolecularWeight: 592.5498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=NC(=CS4)C5=CC=C(C=C5)Br)C(C)C

Isomeric SMILES

CC1CN(CCN1C(=O)CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=NC(=CS4)C5=CC=C(C=C5)Br)C(C)C

InChI

InChI=1S/C29H30BrN5O2S/c1-19(2)27-24(16-31-35(27)29-32-25(18-38-29)22-9-11-23(30)12-10-22)28(37)33-13-14-34(20(3)17-33)26(36)15-21-7-5-4-6-8-21/h4-12,16,18-20H,13-15,17H2,1-3H3