cyclohexyl-[(2S)-2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone

Systemtic Name: cyclohexyl-[(2S)-2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone Openeye Name: cyclohexyl-[(2S)-2-methyl-4-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone CAS Name: cyclohexyl-[(2S)-2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-1-piperazinyl]methanone IUPAC Name: cyclohexyl-[(2S)-2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone Traditional Name: cyclohexyl-[(2S)-2-methyl-4-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]piperazino]methanone Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2CCCCC2)C3=NC(=NS3)CC4=CC=C(C=C4)C

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)C2CCCCC2)C3=NC(=NS3)CC4=CC=C(C=C4)C

InChI

InChI=1S/C22H30N4OS/c1-16-8-10-18(11-9-16)14-20-23-22(28-24-20)25-12-13-26(17(2)15-25)21(27)19-6-4-3-5-7-19/h8-11,17,19H,3-7,12-15H2,1-2H3/t17-/m0/s1