4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl cyclohexanecarboxylate

Systemtic Name: 4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl cyclohexanecarboxylate Openeye Name: 4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid 4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl ester IUPAC Name: 4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid 4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl ester Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)C(=O)OCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C22H31N3O2S/c26-22(18-8-2-1-3-9-18)27-17-7-6-12-24-13-15-25(16-14-24)21-19-10-4-5-11-20(19)28-23-21/h4-5,10-11,18H,1-3,6-9,12-17H2