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

Systemtic Name: N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-1-methyl-piperidine-3-carboxamide Openeye Name: N-[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-1-methyl-piperidine-3-carboxamide CAS Name: N-[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1,3-benzothiazol-6-yl]-1-methyl-3-piperidinecarboxamide IUPAC Name: N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-1-methylpiperidine-3-carboxamide Traditional Name: N-[2-[(3,5-dimethylisoxazol-4-yl)methylthio]-1,3-benzothiazol-6-yl]-1-methyl-nipecotamide Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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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)C4CCCN(C4)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCCN(C4)C

InChI

InChI=1S/C20H24N4O2S2/c1-12-16(13(2)26-23-12)11-27-20-22-17-7-6-15(9-18(17)28-20)21-19(25)14-5-4-8-24(3)10-14/h6-7,9,14H,4-5,8,10-11H2,1-3H3,(H,21,25)