(4-butylcyclohexyl)-[4-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (4-butylcyclohexyl)-[4-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (4-butylcyclohexyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (4-butylcyclohexyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (4-butylcyclohexyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (4-butylcyclohexyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C22H30FN3OS MolecularWeight: 403.556503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C22H30FN3OS/c1-2-3-4-16-5-7-17(8-6-16)21(27)25-11-13-26(14-12-25)22-24-19-10-9-18(23)15-20(19)28-22/h9-10,15-17H,2-8,11-14H2,1H3