2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3SCC4=C(ON=C4C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3SCC4=C(ON=C4C)C

InChI

InChI=1S/C22H21N3O2S2/c1-4-15-9-10-18-20(11-15)29-22(23-18)24-21(26)16-7-5-6-8-19(16)28-12-17-13(2)25-27-14(17)3/h5-11H,4,12H2,1-3H3,(H,23,24,26)