4-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide Openeye Name: 4-[1-[(3,5-dimethylisoxazol-4-yl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide CAS Name: 4-[1-[(3,5-dimethyl-4-isoxazolyl)methyl]-2-imidazolyl]-N-[3-(methylthio)phenyl]-1-piperidinecarbothioamide IUPAC Name: 4-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]imidazol-2-yl]-N-(3-methylsulfanylphenyl)piperidine-1-carbothioamide Traditional Name: 4-[1-[(3,5-dimethylisoxazol-4-yl)methyl]imidazol-2-yl]-N-[3-(methylthio)phenyl]piperidine-1-carbothioamide Formula: C22H27N5OS2 MolecularWeight: 441.61268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC(=CC=C4)SC

Isomeric SMILES

CC1=C(C(=NO1)C)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C22H27N5OS2/c1-15-20(16(2)28-25-15)14-27-12-9-23-21(27)17-7-10-26(11-8-17)22(29)24-18-5-4-6-19(13-18)30-3/h4-6,9,12-13,17H,7-8,10-11,14H2,1-3H3,(H,24,29)