N-[[2-[4-[(2S)-butan-2-yl]phenoxy]ethanoylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[2-[4-[(2S)-butan-2-yl]phenoxy]ethanoylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[[2-[4-[(1S)-1-methylpropyl]phenoxy]acetyl]amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[2-[4-[(2S)-butan-2-yl]phenoxy]-1-oxoethyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[[2-[4-[(2S)-butan-2-yl]phenoxy]acetyl]amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[[2-[4-[(1S)-1-methylpropyl]phenoxy]acetyl]amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2CCCCC2

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2CCCCC2

InChI

InChI=1S/C20H29N3O3S/c1-3-14(2)15-9-11-17(12-10-15)26-13-18(24)22-23-20(27)21-19(25)16-7-5-4-6-8-16/h9-12,14,16H,3-8,13H2,1-2H3,(H,22,24)(H2,21,23,25,27)/t14-/m0/s1