N-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[[2-[(1-bromo-2-naphthyl)oxy]acetyl]amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[2-[(1-bromo-2-naphthalenyl)oxy]-1-oxoethyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[[2-(1-bromo-2-naphthoxy)acetyl]amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NNC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NNC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C20H22BrN3O3S/c21-18-15-9-5-4-6-13(15)10-11-16(18)27-12-17(25)23-24-20(28)22-19(26)14-7-2-1-3-8-14/h4-6,9-11,14H,1-3,7-8,12H2,(H,23,25)(H2,22,24,26,28)