N-[(4-methylphenyl)methyl]-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-methylphenyl)methyl]-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide Openeye Name: 2-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]sulfanyl]-N-(p-tolylmethyl)acetamide CAS Name: N-[(4-methylphenyl)methyl]-2-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]thio]acetamide IUPAC Name: N-[(4-methylphenyl)methyl]-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetamide Traditional Name: N-(4-methylbenzyl)-2-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)thio]acetamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H25N3O4S2/c1-16-5-7-17(8-6-16)14-23-21(26)15-30-22-24-19-13-18(9-10-20(19)29-22)31(27,28)25-11-3-2-4-12-25/h5-10,13H,2-4,11-12,14-15H2,1H3,(H,23,26)