(3S)-1-[(2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(2S)-3-methyl-2-[[(E)-styryl]sulfonylamino]butanoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(2S)-3-methyl-1-oxo-2-[[(E)-2-phenylethenyl]sulfonylamino]butyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[(2S)-3-methyl-2-[[(E)-styryl]sulfonylamino]butanoyl]-N-phenyl-nipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC(C1)C(=O)NC2=CC=CC=C2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC[C@@H](C1)C(=O)NC2=CC=CC=C2)NS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H31N3O4S/c1-19(2)23(27-33(31,32)17-15-20-10-5-3-6-11-20)25(30)28-16-9-12-21(18-28)24(29)26-22-13-7-4-8-14-22/h3-8,10-11,13-15,17,19,21,23,27H,9,12,16,18H2,1-2H3,(H,26,29)/b17-15+/t21-,23-/m0/s1