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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H21N3O2S2/c1-14-17(15(2)27-24-14)13-28-19-10-6-4-8-16(19)22(26)25(3)12-21-23-18-9-5-7-11-20(18)29-21/h4-11H,12-13H2,1-3H3