N-[(3-acetamidophenyl)methyl]-2-chloranyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3-acetamidophenyl)methyl]-2-chloranyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3-acetamidophenyl)methyl]-2-chloro-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[(3-acetamidophenyl)methyl]-2-chloro-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(3-acetamidophenyl)methyl]-2-chloro-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3-acetamidobenzyl)-2-chloro-5-piperidinosulfonyl-benzamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-15(26)24-17-7-5-6-16(12-17)14-23-21(27)19-13-18(8-9-20(19)22)30(28,29)25-10-3-2-4-11-25/h5-9,12-13H,2-4,10-11,14H2,1H3,(H,23,27)(H,24,26)