N-[4-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylcarbamothioylamino]carbamoyl]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylcarbamothioylamino]carbamoyl]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[[2-[(1-bromo-2-naphthyl)oxy]acetyl]carbamothioylamino]carbamoyl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[[[[2-[(1-bromo-2-naphthalenyl)oxy]-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[[2-(1-bromonaphthalen-2-yl)oxyacetyl]carbamothioylamino]carbamoyl]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[[2-(1-bromo-2-naphthoxy)acetyl]thiocarbamoylamino]carbamoyl]phenyl]-3-methyl-butyramide Formula: C25H25BrN4O4S MolecularWeight: 557.4594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25BrN4O4S/c1-15(2)13-21(31)27-18-10-7-17(8-11-18)24(33)29-30-25(35)28-22(32)14-34-20-12-9-16-5-3-4-6-19(16)23(20)26/h3-12,15H,13-14H2,1-2H3,(H,27,31)(H,29,33)(H2,28,30,32,35)