3-[2-[4-(8-methoxyoctyl)cyclohexyl]piperazin-1-yl]-5-phenyl-2H-1,3,4-thiadiazole

Systemtic Name: 3-[2-[4-(8-methoxyoctyl)cyclohexyl]piperazin-1-yl]-5-phenyl-2H-1,3,4-thiadiazole Openeye Name: 3-[2-[4-(8-methoxyoctyl)cyclohexyl]piperazin-1-yl]-5-phenyl-2H-1,3,4-thiadiazole CAS Name: 3-[2-[4-(8-methoxyoctyl)cyclohexyl]-1-piperazinyl]-5-phenyl-2H-1,3,4-thiadiazole IUPAC Name: 3-[2-[4-(8-methoxyoctyl)cyclohexyl]piperazin-1-yl]-5-phenyl-2H-1,3,4-thiadiazole Traditional Name: 3-[2-[4-(8-methoxyoctyl)cyclohexyl]piperazino]-5-phenyl-2H-1,3,4-thiadiazole Formula: C27H44N4OS MolecularWeight: 472.72946

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCCCCC1CCC(CC1)C2CNCCN2N3CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

COCCCCCCCCC1CCC(CC1)C2CNCCN2N3CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C27H44N4OS/c1-32-20-10-5-3-2-4-7-11-23-14-16-24(17-15-23)26-21-28-18-19-30(26)31-22-33-27(29-31)25-12-8-6-9-13-25/h6,8-9,12-13,23-24,26,28H,2-5,7,10-11,14-22H2,1H3