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

Systemtic Name: N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-4-methoxy-cyclohexane-1-carboxamide Openeye Name: N-[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-4-methoxy-cyclohexanecarboxamide CAS Name: N-[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1,3-benzothiazol-6-yl]-4-methoxy-1-cyclohexanecarboxamide IUPAC Name: N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-4-methoxycyclohexane-1-carboxamide Traditional Name: N-[2-[(3,5-dimethylisoxazol-4-yl)methylthio]-1,3-benzothiazol-6-yl]-4-methoxy-cyclohexanecarboxamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCC(CC4)OC

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCC(CC4)OC

InChI

InChI=1S/C21H25N3O3S2/c1-12-17(13(2)27-24-12)11-28-21-23-18-9-6-15(10-19(18)29-21)22-20(25)14-4-7-16(26-3)8-5-14/h6,9-10,14,16H,4-5,7-8,11H2,1-3H3,(H,22,25)