N-[6-[2-(4-butan-2-ylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]propanamide

Systemtic Name: N-[6-[2-(4-butan-2-ylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]propanamide Openeye Name: N-[6-[[2-(4-sec-butylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]propanamide CAS Name: N-[6-[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]propanamide IUPAC Name: N-[6-[[2-(4-butan-2-ylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]propanamide Traditional Name: N-[6-[[2-(4-sec-butylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]propionamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)CC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)CC

InChI

InChI=1S/C22H25N3O3S/c1-4-14(3)15-6-9-17(10-7-15)28-13-21(27)23-16-8-11-18-19(12-16)29-22(24-18)25-20(26)5-2/h6-12,14H,4-5,13H2,1-3H3,(H,23,27)(H,24,25,26)