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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC=CC=C3SCC4=C(ON=C4C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC=CC=C3SCC4=C(ON=C4C)C)C

InChI

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