ethyl 1-[2-[methyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[methyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[methyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[methyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[methyl-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[methyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]acetyl]isonipecotic acid ethyl ester Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(C)C2=NC(=NS2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(C)C2=NC(=NS2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C21H28N4O3S/c1-4-28-20(27)17-9-11-25(12-10-17)19(26)14-24(3)21-22-18(23-29-21)13-16-7-5-15(2)6-8-16/h5-8,17H,4,9-14H2,1-3H3