N-[3-(2-methylpropanoylamino)phenyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(2-methylpropanoylamino)phenyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(2-methylpropanoylamino)phenyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[3-(2-methylpropanoylamino)phenyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(isobutyrylamino)phenyl]-1-propylsulfonyl-nipecotamide Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)C

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)C

InChI

InChI=1S/C19H29N3O4S/c1-4-11-27(25,26)22-10-6-7-15(13-22)19(24)21-17-9-5-8-16(12-17)20-18(23)14(2)3/h5,8-9,12,14-15H,4,6-7,10-11,13H2,1-3H3,(H,20,23)(H,21,24)