1-[4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]-3,5,5-trimethyl-hexan-1-one

Systemtic Name: 1-[4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-[4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]-3,5,5-trimethyl-hexan-1-one CAS Name: 1-[4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-1-piperazinyl]-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-[4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methylpiperazin-1-yl]-3,5,5-trimethylhexan-1-one Traditional Name: 1-[4-(3-m-anisyl-1,2,4-thiadiazol-5-yl)-2-methyl-piperazino]-3,5,5-trimethyl-hexan-1-one Formula: C24H36N4O2S MolecularWeight: 444.63324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC(C)CC(C)(C)C)C2=NC(=NS2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC1CN(CCN1C(=O)CC(C)CC(C)(C)C)C2=NC(=NS2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C24H36N4O2S/c1-17(15-24(3,4)5)12-22(29)28-11-10-27(16-18(28)2)23-25-21(26-31-23)14-19-8-7-9-20(13-19)30-6/h7-9,13,17-18H,10-12,14-16H2,1-6H3