N-(3-methylbutyl)-1-[3-[(4-propylphenyl)sulfonylamino]phenyl]carbonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-[3-[(4-propylphenyl)sulfonylamino]phenyl]carbonyl-piperidine-3-carboxamide Openeye Name: N-isopentyl-1-[3-[(4-propylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide CAS Name: N-(3-methylbutyl)-1-[oxo-[3-[(4-propylphenyl)sulfonylamino]phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-[3-[(4-propylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide Traditional Name: N-isoamyl-1-[3-[(4-propylphenyl)sulfonylamino]benzoyl]nipecotamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCCC(C3)C(=O)NCCC(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N3CCCC(C3)C(=O)NCCC(C)C

InChI

InChI=1S/C27H37N3O4S/c1-4-7-21-11-13-25(14-12-21)35(33,34)29-24-10-5-8-22(18-24)27(32)30-17-6-9-23(19-30)26(31)28-16-15-20(2)3/h5,8,10-14,18,20,23,29H,4,6-7,9,15-17,19H2,1-3H3,(H,28,31)