1-[2-methyl-4-[1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-propan-2-yl-pyrazol-4-yl]carbonyl-piperazin-1-yl]heptan-1-one

Systemtic Name: 1-[2-methyl-4-[1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-propan-2-yl-pyrazol-4-yl]carbonyl-piperazin-1-yl]heptan-1-one Openeye Name: 1-[4-[5-isopropyl-1-[4-(p-tolyl)thiazol-2-yl]pyrazole-4-carbonyl]-2-methyl-piperazin-1-yl]heptan-1-one CAS Name: 1-[2-methyl-4-[[1-[4-(4-methylphenyl)-2-thiazolyl]-5-propan-2-yl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-1-heptanone IUPAC Name: 1-[2-methyl-4-[1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-propan-2-ylpyrazole-4-carbonyl]piperazin-1-yl]heptan-1-one Traditional Name: 1-[4-[5-isopropyl-1-[4-(p-tolyl)thiazol-2-yl]pyrazole-4-carbonyl]-2-methyl-piperazino]heptan-1-one Formula: C29H39N5O2S MolecularWeight: 521.71726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H39N5O2S/c1-6-7-8-9-10-26(35)33-16-15-32(18-22(33)5)28(36)24-17-30-34(27(24)20(2)3)29-31-25(19-37-29)23-13-11-21(4)12-14-23/h11-14,17,19-20,22H,6-10,15-16,18H2,1-5H3