3-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide

Systemtic Name: 3-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Openeye Name: 3-(2-oxo-1,3-benzoxazol-3-yl)-N-[[5-(1-piperidylsulfonyl)-2-thienyl]methyl]propanamide CAS Name: 3-(2-oxo-1,3-benzoxazol-3-yl)-N-[[5-(1-piperidinylsulfonyl)-2-thiophenyl]methyl]propanamide IUPAC Name: 3-(2-oxo-1,3-benzoxazol-3-yl)-N-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Traditional Name: 3-(2-keto-1,3-benzoxazol-3-yl)-N-[(5-piperidinosulfonyl-2-thienyl)methyl]propionamide Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)CCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CNC(=O)CCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H23N3O5S2/c24-18(10-13-23-16-6-2-3-7-17(16)28-20(23)25)21-14-15-8-9-19(29-15)30(26,27)22-11-4-1-5-12-22/h2-3,6-9H,1,4-5,10-14H2,(H,21,24)