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

Systemtic Name: N-[6-[2-(4-propan-2-ylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]propanamide Openeye Name: N-[6-[[2-(4-isopropylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]propanamide CAS Name: N-[6-[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]amino]-1,3-benzothiazol-2-yl]propanamide IUPAC Name: N-[6-[[2-(4-propan-2-ylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]propanamide Traditional Name: N-[6-[[2-(4-isopropylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-4-19(25)24-21-23-17-10-7-15(11-18(17)28-21)22-20(26)12-27-16-8-5-14(6-9-16)13(2)3/h5-11,13H,4,12H2,1-3H3,(H,22,26)(H,23,24,25)