N-[4-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylcarbamothioylamino]carbamoyl]phenyl]propanamide

Systemtic Name: N-[4-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylcarbamothioylamino]carbamoyl]phenyl]propanamide Openeye Name: N-[4-[[[2-[(1-bromo-2-naphthyl)oxy]acetyl]carbamothioylamino]carbamoyl]phenyl]propanamide CAS Name: N-[4-[[[[[2-[(1-bromo-2-naphthalenyl)oxy]-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]propanamide IUPAC Name: N-[4-[[[2-(1-bromonaphthalen-2-yl)oxyacetyl]carbamothioylamino]carbamoyl]phenyl]propanamide Traditional Name: N-[4-[[[2-(1-bromo-2-naphthoxy)acetyl]thiocarbamoylamino]carbamoyl]phenyl]propionamide Formula: C23H21BrN4O4S MolecularWeight: 529.40624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C23H21BrN4O4S/c1-2-19(29)25-16-10-7-15(8-11-16)22(31)27-28-23(33)26-20(30)13-32-18-12-9-14-5-3-4-6-17(14)21(18)24/h3-12H,2,13H2,1H3,(H,25,29)(H,27,31)(H2,26,28,30,33)