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-ethyl-hexan-1-one

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-ethyl-hexan-1-one Openeye Name: 1-[4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-isopropyl-pyrazole-4-carbonyl]-2-methyl-piperazin-1-yl]-2-ethyl-hexan-1-one CAS Name: 1-[4-[[1-[4-(4-bromophenyl)-2-thiazolyl]-5-propan-2-yl-4-pyrazolyl]-oxomethyl]-2-methyl-1-piperazinyl]-2-ethyl-1-hexanone IUPAC Name: 1-[4-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-propan-2-ylpyrazole-4-carbonyl]-2-methylpiperazin-1-yl]-2-ethylhexan-1-one Traditional Name: 1-[4-[1-[4-(4-bromophenyl)thiazol-2-yl]-5-isopropyl-pyrazole-4-carbonyl]-2-methyl-piperazino]-2-ethyl-hexan-1-one Formula: C29H38BrN5O2S MolecularWeight: 600.61332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1C)C(=O)C2=C(N(N=C2)C3=NC(=CS3)C4=CC=C(C=C4)Br)C(C)C

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1C)C(=O)C2=C(N(N=C2)C3=NC(=CS3)C4=CC=C(C=C4)Br)C(C)C

InChI

InChI=1S/C29H38BrN5O2S/c1-6-8-9-21(7-2)27(36)34-15-14-33(17-20(34)5)28(37)24-16-31-35(26(24)19(3)4)29-32-25(18-38-29)22-10-12-23(30)13-11-22/h10-13,16,18-21H,6-9,14-15,17H2,1-5H3