N-[6-[2-(4-cyclohexylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]butanamide

Systemtic Name: N-[6-[2-(4-cyclohexylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]butanamide Openeye Name: N-[6-[[2-(4-cyclohexylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide CAS Name: N-[6-[[2-(4-cyclohexylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]butanamide IUPAC Name: N-[6-[[2-(4-cyclohexylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide Traditional Name: N-[6-[[2-(4-cyclohexylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butyramide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C25H29N3O3S/c1-2-6-23(29)28-25-27-21-14-11-19(15-22(21)32-25)26-24(30)16-31-20-12-9-18(10-13-20)17-7-4-3-5-8-17/h9-15,17H,2-8,16H2,1H3,(H,26,30)(H,27,28,29)