3-bromanyl-4-(3-methylbutoxy)-N-[(2-naphthalen-2-yloxyethanoylamino)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-[(2-naphthalen-2-yloxyethanoylamino)carbamothioyl]benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-[[[2-(2-naphthyloxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[[[2-(2-naphthalenyloxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-[[(2-naphthalen-2-yloxyacetyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-isoamoxy-N-[[[2-(2-naphthoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C25H26BrN3O4S MolecularWeight: 544.46064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C25H26BrN3O4S/c1-16(2)11-12-32-22-10-8-19(14-21(22)26)24(31)27-25(34)29-28-23(30)15-33-20-9-7-17-5-3-4-6-18(17)13-20/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,28,30)(H2,27,29,31,34)