N-[5-[2-(4-chloranylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[5-[2-(4-chloranylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[5-[[2-(4-chlorophenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[5-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[5-[[2-(4-chlorophenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[5-[[2-(4-chlorophenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O3S/c23-15-6-9-17(10-7-15)29-13-20(27)24-16-8-11-19-18(12-16)25-22(30-19)26-21(28)14-4-2-1-3-5-14/h6-12,14H,1-5,13H2,(H,24,27)(H,25,26,28)