3-[1-(2,1,3-benzothiadiazol-5-ylmethyl)piperidin-3-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide

Systemtic Name: 3-[1-(2,1,3-benzothiadiazol-5-ylmethyl)piperidin-3-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide Openeye Name: 3-[1-(2,1,3-benzothiadiazol-5-ylmethyl)-3-piperidyl]-N-[(5-methyl-2-furyl)methyl]propanamide CAS Name: 3-[1-(2,1,3-benzothiadiazol-5-ylmethyl)-3-piperidinyl]-N-[(5-methyl-2-furanyl)methyl]propanamide IUPAC Name: 3-[1-(2,1,3-benzothiadiazol-5-ylmethyl)piperidin-3-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide Traditional Name: N-[(5-methyl-2-furyl)methyl]-3-[1-(piazthiol-5-ylmethyl)-3-piperidyl]propionamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)CCC2CCCN(C2)CC3=CC4=NSN=C4C=C3

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)CCC2CCCN(C2)CC3=CC4=NSN=C4C=C3

InChI

InChI=1S/C21H26N4O2S/c1-15-4-7-18(27-15)12-22-21(26)9-6-16-3-2-10-25(13-16)14-17-5-8-19-20(11-17)24-28-23-19/h4-5,7-8,11,16H,2-3,6,9-10,12-14H2,1H3,(H,22,26)