butyl 2-[2-(4-cyclohexylphenoxy)ethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[2-(4-cyclohexylphenoxy)ethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[[2-(4-cyclohexylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-(4-cyclohexylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[[2-(4-cyclohexylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(4-cyclohexylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C26H30N2O4S/c1-2-3-15-31-25(30)20-11-14-22-23(16-20)33-26(27-22)28-24(29)17-32-21-12-9-19(10-13-21)18-7-5-4-6-8-18/h9-14,16,18H,2-8,15,17H2,1H3,(H,27,28,29)