N-[2-methyl-5-(propanoylamino)phenyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-methyl-5-(propanoylamino)phenyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-methyl-5-(propanoylamino)phenyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-methyl-5-(1-oxopropylamino)phenyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-methyl-5-(propanoylamino)phenyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-methyl-5-propionamido-phenyl)-3-piperidinosulfonyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27N3O4S/c1-3-21(26)23-18-11-10-16(2)20(15-18)24-22(27)17-8-7-9-19(14-17)30(28,29)25-12-5-4-6-13-25/h7-11,14-15H,3-6,12-13H2,1-2H3,(H,23,26)(H,24,27)