1-[4-[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]sulfonylpiperidine-4-carboxamide

Systemtic Name: 1-[4-[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]sulfonylpiperidine-4-carboxamide Openeye Name: 1-[4-[(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethoxy]phenyl]sulfonylpiperidine-4-carboxamide CAS Name: 1-[4-[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]oxyphenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-[4-[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]oxyphenyl]sulfonylpiperidine-4-carboxamide Traditional Name: 1-[4-[(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethoxy]phenyl]sulfonylisonipecotamide Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCC1)OC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H31N3O5S/c1-15(21(26)23-17-5-3-2-4-6-17)29-18-7-9-19(10-8-18)30(27,28)24-13-11-16(12-14-24)20(22)25/h7-10,15-17H,2-6,11-14H2,1H3,(H2,22,25)(H,23,26)/t15-/m0/s1