1-[2-(butan-2-ylsulfamoyl)-4-(3-chloranylpropanoylamino)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(butan-2-ylsulfamoyl)-4-(3-chloranylpropanoylamino)phenyl]piperidine-4-carboxamide Openeye Name: 1-[4-(3-chloropropanoylamino)-2-(sec-butylsulfamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[2-(butan-2-ylsulfamoyl)-4-[(3-chloro-1-oxopropyl)amino]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(butan-2-ylsulfamoyl)-4-(3-chloropropanoylamino)phenyl]piperidine-4-carboxamide Traditional Name: 1-[4-(3-chloropropanoylamino)-2-(sec-butylsulfamoyl)phenyl]isonipecotamide Formula: C19H29ClN4O4S MolecularWeight: 444.97596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=C(C=CC(=C1)NC(=O)CCCl)N2CCC(CC2)C(=O)N

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=C(C=CC(=C1)NC(=O)CCCl)N2CCC(CC2)C(=O)N

InChI

InChI=1S/C19H29ClN4O4S/c1-3-13(2)23-29(27,28)17-12-15(22-18(25)6-9-20)4-5-16(17)24-10-7-14(8-11-24)19(21)26/h4-5,12-14,23H,3,6-11H2,1-2H3,(H2,21,26)(H,22,25)