ethyl 1-[1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]piperidine-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-4-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]isonipecotoyl]nipecotic acid ethyl ester Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)C3=NC(=NS3)CC4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)C3=NC(=NS3)CC4=CC=C(C=C4)C

InChI

InChI=1S/C24H32N4O3S/c1-3-31-23(30)20-5-4-12-28(16-20)22(29)19-10-13-27(14-11-19)24-25-21(26-32-24)15-18-8-6-17(2)7-9-18/h6-9,19-20H,3-5,10-16H2,1-2H3