4-chloranyl-N-[4-(2-methylpropanoylamino)phenyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[4-(2-methylpropanoylamino)phenyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[4-(2-methylpropanoylamino)phenyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-chloro-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[4-(2-methylpropanoylamino)phenyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[4-(isobutyrylamino)phenyl]-3-piperidinosulfonyl-benzamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O4S/c1-15(2)21(27)24-17-7-9-18(10-8-17)25-22(28)16-6-11-19(23)20(14-16)31(29,30)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,24,27)(H,25,28)