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

Systemtic Name: N-[6-[2-(2,3-dimethylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]butanamide Openeye Name: N-[6-[[2-(2,3-dimethylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide CAS Name: N-[6-[[2-(2,3-dimethylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]butanamide IUPAC Name: N-[6-[[2-(2,3-dimethylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide Traditional Name: N-[6-[[2-(2,3-dimethylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butyramide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=CC(=C3C)C

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=CC(=C3C)C

InChI

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