1-[2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]nonan-1-one

Systemtic Name: 1-[2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]nonan-1-one Openeye Name: 1-[2-methyl-4-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]piperazin-1-yl]nonan-1-one CAS Name: 1-[2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-1-piperazinyl]-1-nonanone IUPAC Name: 1-[2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]nonan-1-one Traditional Name: 1-[2-methyl-4-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]piperazino]nonan-1-one Formula: C24H36N4OS MolecularWeight: 428.63384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)N1CCN(CC1C)C2=NC(=NS2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCCC(=O)N1CCN(CC1C)C2=NC(=NS2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C24H36N4OS/c1-4-5-6-7-8-9-10-23(29)28-16-15-27(18-20(28)3)24-25-22(26-30-24)17-21-13-11-19(2)12-14-21/h11-14,20H,4-10,15-18H2,1-3H3