N-[4-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylcarbamothioylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide

Systemtic Name: N-[4-[[2-(1-bromanylnaphthalen-2-yl)oxyethanoylcarbamothioylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[4-[[[2-[(1-bromo-2-naphthyl)oxy]acetyl]carbamothioylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide CAS Name: N-[4-[[[[[2-[(1-bromo-2-naphthalenyl)oxy]-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[4-[[[2-(1-bromonaphthalen-2-yl)oxyacetyl]carbamothioylamino]carbamoyl]phenyl]-4-tert-butylbenzamide Traditional Name: N-[4-[[[2-(1-bromo-2-naphthoxy)acetyl]thiocarbamoylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide Formula: C31H29BrN4O4S MolecularWeight: 633.55536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)COC3=C(C4=CC=CC=C4C=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)COC3=C(C4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C31H29BrN4O4S/c1-31(2,3)22-13-8-20(9-14-22)28(38)33-23-15-10-21(11-16-23)29(39)35-36-30(41)34-26(37)18-40-25-17-12-19-6-4-5-7-24(19)27(25)32/h4-17H,18H2,1-3H3,(H,33,38)(H,35,39)(H2,34,36,37,41)