5-[(4-cyclopentylcarbonylpiperazin-1-yl)methyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(4-cyclopentylcarbonylpiperazin-1-yl)methyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[[4-(cyclopentanecarbonyl)piperazin-1-yl]methyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[4-[cyclopentyl(oxo)methyl]-1-piperazinyl]methyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[[4-(cyclopentanecarbonyl)piperazin-1-yl]methyl]-N-[(4-fluorophenyl)methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[[4-(cyclopentanecarbonyl)piperazino]methyl]-N-(4-fluorobenzyl)-1,3,4-thiadiazole-2-carboxamide Formula: C21H26FN5O2S MolecularWeight: 431.526843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCN(CC2)CC3=NN=C(S3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(C1)C(=O)N2CCN(CC2)CC3=NN=C(S3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H26FN5O2S/c22-17-7-5-15(6-8-17)13-23-19(28)20-25-24-18(30-20)14-26-9-11-27(12-10-26)21(29)16-3-1-2-4-16/h5-8,16H,1-4,9-14H2,(H,23,28)