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

Systemtic Name: 1-[4-[1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-propan-2-yl-pyrazol-4-yl]carbonyl-2-methyl-piperazin-1-yl]octan-1-one Openeye Name: 1-[4-[5-isopropyl-1-[4-(3-methoxyphenyl)thiazol-2-yl]pyrazole-4-carbonyl]-2-methyl-piperazin-1-yl]octan-1-one CAS Name: 1-[4-[[1-[4-(3-methoxyphenyl)-2-thiazolyl]-5-propan-2-yl-4-pyrazolyl]-oxomethyl]-2-methyl-1-piperazinyl]-1-octanone IUPAC Name: 1-[4-[1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-propan-2-ylpyrazole-4-carbonyl]-2-methylpiperazin-1-yl]octan-1-one Traditional Name: 1-[4-[5-isopropyl-1-[4-(3-methoxyphenyl)thiazol-2-yl]pyrazole-4-carbonyl]-2-methyl-piperazino]octan-1-one Formula: C30H41N5O3S MolecularWeight: 551.74324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H41N5O3S/c1-6-7-8-9-10-14-27(36)34-16-15-33(19-22(34)4)29(37)25-18-31-35(28(25)21(2)3)30-32-26(20-39-30)23-12-11-13-24(17-23)38-5/h11-13,17-18,20-22H,6-10,14-16,19H2,1-5H3