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

Systemtic Name: ethyl 1-[3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[isopropyl-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]amino]propanoyl]piperidine-3-carboxylate CAS Name: 1-[3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[isopropyl-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]amino]propanoyl]nipecotic acid ethyl ester Formula: C24H34N4O3S MolecularWeight: 458.61676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCN(C2=NC(=NS2)CC3=CC=C(C=C3)C)C(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCN(C2=NC(=NS2)CC3=CC=C(C=C3)C)C(C)C

InChI

InChI=1S/C24H34N4O3S/c1-5-31-23(30)20-7-6-13-27(16-20)22(29)12-14-28(17(2)3)24-25-21(26-32-24)15-19-10-8-18(4)9-11-19/h8-11,17,20H,5-7,12-16H2,1-4H3